N-(2-bromoethyl)-6-oxidanylidene-5H-pyrido[2,3-b][1,4]benzodiazepine-11-carboxamide

Systemtic Name: N-(2-bromoethyl)-6-oxidanylidene-5H-pyrido[2,3-b][1,4]benzodiazepine-11-carboxamide Openeye Name: N-(2-bromoethyl)-6-oxo-5H-pyrido[2,3-b][1,4]benzodiazepine-11-carboxamide CAS Name: N-(2-bromoethyl)-6-oxo-5H-pyrido[2,3-b][1,4]benzodiazepine-11-carboxamide IUPAC Name: N-(2-bromoethyl)-6-oxo-5H-pyrido[2,3-b][1,4]benzodiazepine-11-carboxamide Traditional Name: N-(2-bromoethyl)-6-keto-5H-pyrido[2,3-b][1,4]benzodiazepine-11-carboxamide Formula: C15H13BrN4O2 MolecularWeight: 361.19332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NC3=C(N2C(=O)NCCBr)N=CC=C3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NC3=C(N2C(=O)NCCBr)N=CC=C3

InChI

InChI=1S/C15H13BrN4O2/c16-7-9-18-15(22)20-12-6-2-1-4-10(12)14(21)19-11-5-3-8-17-13(11)20/h1-6,8H,7,9H2,(H,18,22)(H,19,21)