CHEBI:125351 - N-[[(2R,4R)-4-[acetyl-[(4-methyl-5-isoquinolinyl)sulfonyl]amino]-2-pyrrolidinyl]methyl]acetamide

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ChEBI Name N-[[(2R,4R)-4-[acetyl-[(4-methyl-5-isoquinolinyl)sulfonyl]amino]-2-pyrrolidinyl]methyl]acetamide
ChEBI ID CHEBI:125351
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C19H24N4O4S
Net Charge 0
Average Mass 404.485
Monoisotopic Mass 404.15183
InChI InChI=1S/C19H24N4O4S/c1-12-8-20-9-15-5-4-6-18(19(12)15)28(26,27)23(14(3)25)17-7-16(22-11-17)10-21-13(2)24/h4-6,8-9,16-17,22H,7,10-11H2,1-3H3,(H,21,24)/t16-,17-/m1/s1
InChIKey HTNPXDPYAJYFGL-IAGOWNOFSA-N
SMILES CC1=C2C(=CN=C1)C=CC=C2S(=O)(=O)N([C@@H]3C[C@@H](NC3)CNC(=O)C)C(=O)C
ChEBI Ontology
Outgoing N-[[(2R,4R)-4-[acetyl-[(4-methyl-5-isoquinolinyl)sulfonyl]amino]-2-pyrrolidinyl]methyl]acetamide (CHEBI:125351) is a isoquinolines (CHEBI:24922)
Manual Xref Database
LSM-36823 LINCS
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