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

Systemtic Name: (3E)-7-chloranyl-3-[(dibutylamino)methylidene]-5-phenyl-4H-1,4-benzodiazepin-2-one Openeye Name: (3E)-7-chloro-3-[(dibutylamino)methylene]-5-phenyl-4H-1,4-benzodiazepin-2-one CAS Name: (3E)-7-chloro-3-[(dibutylamino)methylidene]-5-phenyl-4H-1,4-benzodiazepin-2-one IUPAC Name: (3E)-7-chloro-3-[(dibutylamino)methylidene]-5-phenyl-4H-1,4-benzodiazepin-2-one Traditional Name: (3E)-7-chloro-3-[(dibutylamino)methylene]-5-phenyl-4H-1,4-benzodiazepin-2-one Formula: C24H28ClN3O MolecularWeight: 409.95162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C=C1C(=O)N=C2C=CC(=CC2=C(N1)C3=CC=CC=C3)Cl

Isomeric SMILES

CCCCN(CCCC)/C=C/1\C(=O)N=C2C=CC(=CC2=C(N1)C3=CC=CC=C3)Cl

InChI

InChI=1S/C24H28ClN3O/c1-3-5-14-28(15-6-4-2)17-22-24(29)27-21-13-12-19(25)16-20(21)23(26-22)18-10-8-7-9-11-18/h7-13,16-17,26H,3-6,14-15H2,1-2H3/b22-17+