(3E)-7-chloranyl-5-phenyl-3-(thiophen-2-ylmethylidene)-4H-1,4-benzodiazepin-2-one

Systemtic Name: (3E)-7-chloranyl-5-phenyl-3-(thiophen-2-ylmethylidene)-4H-1,4-benzodiazepin-2-one Openeye Name: (3E)-7-chloro-5-phenyl-3-(2-thienylmethylene)-4H-1,4-benzodiazepin-2-one CAS Name: (3E)-7-chloro-5-phenyl-3-(thiophen-2-ylmethylidene)-4H-1,4-benzodiazepin-2-one IUPAC Name: (3E)-7-chloro-5-phenyl-3-(thiophen-2-ylmethylidene)-4H-1,4-benzodiazepin-2-one Traditional Name: (3E)-7-chloro-5-phenyl-3-(2-thenylidene)-4H-1,4-benzodiazepin-2-one Formula: C20H13ClN2OS MolecularWeight: 364.84802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=C(C=CC3=NC(=O)C(=CC4=CC=CS4)N2)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=C(C=CC3=NC(=O)/C(=C\C4=CC=CS4)/N2)Cl

InChI

InChI=1S/C20H13ClN2OS/c21-14-8-9-17-16(11-14)19(13-5-2-1-3-6-13)22-18(20(24)23-17)12-15-7-4-10-25-15/h1-12,22H/b18-12+