(3E)-7-chloranyl-3-[(4-dimethylaminophenyl)methylidene]-5-phenyl-4H-1,4-benzodiazepin-2-one

Systemtic Name: (3E)-7-chloranyl-3-[(4-dimethylaminophenyl)methylidene]-5-phenyl-4H-1,4-benzodiazepin-2-one Openeye Name: (3E)-7-chloro-3-[(4-dimethylaminophenyl)methylene]-5-phenyl-4H-1,4-benzodiazepin-2-one CAS Name: (3E)-7-chloro-3-[(4-dimethylaminophenyl)methylidene]-5-phenyl-4H-1,4-benzodiazepin-2-one IUPAC Name: (3E)-7-chloro-3-[(4-dimethylaminophenyl)methylidene]-5-phenyl-4H-1,4-benzodiazepin-2-one Traditional Name: (3E)-7-chloro-3-[4-(dimethylamino)benzylidene]-5-phenyl-4H-1,4-benzodiazepin-2-one Formula: C24H20ClN3O MolecularWeight: 401.8881

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C=C2C(=O)N=C3C=CC(=CC3=C(N2)C4=CC=CC=C4)Cl

Isomeric SMILES

CN(C)C1=CC=C(C=C1)/C=C/2\C(=O)N=C3C=CC(=CC3=C(N2)C4=CC=CC=C4)Cl

InChI

InChI=1S/C24H20ClN3O/c1-28(2)19-11-8-16(9-12-19)14-22-24(29)27-21-13-10-18(25)15-20(21)23(26-22)17-6-4-3-5-7-17/h3-15,26H,1-2H3/b22-14+