CHEBI:91380 - 2-[4-(4-hydroxy-1-piperidinyl)anilino]-5,11-dimethyl-6-pyrimido[4,5-b][1,4]benzodiazepinone

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ChEBI Name 2-[4-(4-hydroxy-1-piperidinyl)anilino]-5,11-dimethyl-6-pyrimido[4,5-b][1,4]benzodiazepinone
ChEBI ID CHEBI:91380
Stars This entity has been manually annotated by a third party.
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Formula C24H26N6O2
Net Charge 0
Average Mass 430.503
Monoisotopic Mass 430.21172
InChI InChI=1S/C24H26N6O2/c1-28-20-6-4-3-5-19(20)23(32)29(2)21-15-25-24(27-22(21)28)26-16-7-9-17(10-8-16)30-13-11-18(31)12-14-30/h3-10,15,18,31H,11-14H2,1-2H3,(H,25,26,27)
InChIKey DFQAJLQXPSPNJE-UHFFFAOYSA-N
SMILES CN1C2=CC=CC=C2C(=O)N(C3=CN=C(N=C31)NC4=CC=C(C=C4)N5CCC(CC5)O)C
ChEBI Ontology
Outgoing 2-[4-(4-hydroxy-1-piperidinyl)anilino]-5,11-dimethyl-6-pyrimido[4,5-b][1,4]benzodiazepinone (CHEBI:91380) is a piperidines (CHEBI:26151)
Manual Xref Database
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