Ketcher 03121915232D 1 1.00000 0.00000 0 30 33 0 0 0 999 V2000 18.8984 -7.5329 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.8984 -8.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0324 -9.0329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0324 -10.0331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1664 -10.5330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3002 -10.0331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4342 -10.5330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.5682 -10.0331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7022 -10.5330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8361 -10.0331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9700 -10.5330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1039 -10.0331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1039 -9.0329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2378 -8.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3719 -9.0329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5057 -8.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5057 -7.5329 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3719 -7.0329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2378 -7.5329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9700 -8.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8361 -9.0329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7022 -8.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5682 -9.0329 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.3002 -9.0329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1664 -8.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7645 -9.0329 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 20.6306 -8.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.4967 -9.0329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3627 -8.5332 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.2288 -9.0329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 2 3 1 0 0 0 3 4 2 0 0 0 4 5 1 0 0 0 5 6 2 0 0 0 6 7 1 0 0 0 7 8 1 0 0 0 8 9 2 0 0 0 9 10 1 0 0 0 10 11 2 0 0 0 11 12 1 0 0 0 12 13 2 0 0 0 13 14 1 0 0 0 14 15 2 0 0 0 15 16 1 0 0 0 16 17 2 0 0 0 17 18 1 0 0 0 18 19 2 0 0 0 14 19 1 0 0 0 13 20 1 0 0 0 20 21 2 0 0 0 10 21 1 0 0 0 21 22 1 0 0 0 22 23 2 0 0 0 8 23 1 0 0 0 6 24 1 0 0 0 24 25 2 0 0 0 3 25 1 0 0 0 2 26 1 0 0 0 26 27 1 0 0 0 27 28 1 0 0 0 28 29 1 0 0 0 29 30 1 0 0 0 M END > CHEBI:143119 > N-(2-methoxyethyl)-4-{[6-(pyridin-4-yl)quinazolin-2-yl]amino}benzamide > A member of the class of quinazolines that is quinazoline which is substituted by a {4-[(2-methoxyethyl)carbamoyl]phenyl}nitrilo group and a pyridin-4-yl group at positions 2 and 6, respectively. It is a B-Raf and MKNK2 kinase inhibitor. > 3 > UNC-BE1-004 > N-(2-methoxyethyl)-4-{[6-(pyridin-4-yl)quinazolin-2-yl]amino}benzamide > C23H21N5O2 > 399.454 > 399.16952 > 0 > O=C(C1=CC=C(NC2=NC3=CC=C(C4=CC=NC=C4)C=C3C=N2)C=C1)NCCOC > InChI=1S/C23H21N5O2/c1-30-13-12-25-22(29)17-2-5-20(6-3-17)27-23-26-15-19-14-18(4-7-21(19)28-23)16-8-10-24-11-9-16/h2-11,14-15H,12-13H2,1H3,(H,25,29)(H,26,27,28) > NXVFABZXYFFUBF-UHFFFAOYSA-N > 32W > 23398453 $$$$