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

Systemtic Name: (3E)-7-chloranyl-3-[(dipropylamino)methylidene]-5-phenyl-4H-1,4-benzodiazepin-2-one Openeye Name: (3E)-7-chloro-3-[(dipropylamino)methylene]-5-phenyl-4H-1,4-benzodiazepin-2-one CAS Name: (3E)-7-chloro-3-[(dipropylamino)methylidene]-5-phenyl-4H-1,4-benzodiazepin-2-one IUPAC Name: (3E)-7-chloro-3-[(dipropylamino)methylidene]-5-phenyl-4H-1,4-benzodiazepin-2-one Traditional Name: (3E)-7-chloro-3-[(dipropylamino)methylene]-5-phenyl-4H-1,4-benzodiazepin-2-one Formula: C22H24ClN3O MolecularWeight: 381.89846

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C=C1C(=O)N=C2C=CC(=CC2=C(N1)C3=CC=CC=C3)Cl

Isomeric SMILES

CCCN(CCC)/C=C/1\C(=O)N=C2C=CC(=CC2=C(N1)C3=CC=CC=C3)Cl

InChI

InChI=1S/C22H24ClN3O/c1-3-12-26(13-4-2)15-20-22(27)25-19-11-10-17(23)14-18(19)21(24-20)16-8-6-5-7-9-16/h5-11,14-15,24H,3-4,12-13H2,1-2H3/b20-15+