3-[(3E)-3-[(4-aminophenyl)hydrazinylidene]-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]-7-chloranyl-1-methyl-3H-1,4-benzodiazepin-2-one

Systemtic Name: 3-[(3E)-3-[(4-aminophenyl)hydrazinylidene]-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]-7-chloranyl-1-methyl-3H-1,4-benzodiazepin-2-one Openeye Name: 3-[(3E)-3-[(4-aminophenyl)hydrazono]-4-oxo-cyclohexa-1,5-dien-1-yl]-7-chloro-1-methyl-3H-1,4-benzodiazepin-2-one CAS Name: 3-[(3E)-3-[(4-aminophenyl)hydrazinylidene]-4-oxo-1-cyclohexa-1,5-dienyl]-7-chloro-1-methyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 3-[(3E)-3-[(4-aminophenyl)hydrazinylidene]-4-oxocyclohexa-1,5-dien-1-yl]-7-chloro-1-methyl-3H-1,4-benzodiazepin-2-one Traditional Name: 3-[(3E)-3-[(4-aminophenyl)hydrazono]-4-keto-cyclohexa-1,5-dien-1-yl]-7-chloro-1-methyl-3H-1,4-benzodiazepin-2-one Formula: C22H18ClN5O2 MolecularWeight: 419.86362

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)Cl)C=NC(C1=O)C3=CC(=NNC4=CC=C(C=C4)N)C(=O)C=C3

Isomeric SMILES

CN1C2=C(C=C(C=C2)Cl)C=NC(C1=O)C3=C/C(=N\NC4=CC=C(C=C4)N)/C(=O)C=C3

InChI

InChI=1S/C22H18ClN5O2/c1-28-19-8-3-15(23)10-14(19)12-25-21(22(28)30)13-2-9-20(29)18(11-13)27-26-17-6-4-16(24)5-7-17/h2-12,21,26H,24H2,1H3/b27-18+