3-azanyl-7-chloranyl-5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1-(4-phenylphenyl)-3,4-dihydro-1,4-benzodiazepin-2-one

Systemtic Name: 3-azanyl-7-chloranyl-5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1-(4-phenylphenyl)-3,4-dihydro-1,4-benzodiazepin-2-one Openeye Name: 3-amino-7-chloro-5-(4-oxocyclohexa-2,5-dien-1-ylidene)-1-(4-phenylphenyl)-3,4-dihydro-1,4-benzodiazepin-2-one CAS Name: 3-amino-7-chloro-5-(4-oxo-1-cyclohexa-2,5-dienylidene)-1-(4-phenylphenyl)-3,4-dihydro-1,4-benzodiazepin-2-one IUPAC Name: 3-amino-7-chloro-5-(4-oxocyclohexa-2,5-dien-1-ylidene)-1-(4-phenylphenyl)-3,4-dihydro-1,4-benzodiazepin-2-one Traditional Name: 3-amino-7-chloro-5-(4-ketocyclohexa-2,5-dien-1-ylidene)-1-(4-phenylphenyl)-3,4-dihydro-1,4-benzodiazepin-2-one Formula: C27H20ClN3O2 MolecularWeight: 453.9196

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)N3C4=C(C=C(C=C4)Cl)C(=C5C=CC(=O)C=C5)NC(C3=O)N

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)N3C4=C(C=C(C=C4)Cl)C(=C5C=CC(=O)C=C5)NC(C3=O)N

InChI

InChI=1S/C27H20ClN3O2/c28-20-10-15-24-23(16-20)25(19-8-13-22(32)14-9-19)30-26(29)27(33)31(24)21-11-6-18(7-12-21)17-4-2-1-3-5-17/h1-16,26,30H,29H2