3-(3,4-dichlorophenyl)-N-[2-oxidanylidene-5-phenyl-1-[2,2,2-tris(fluoranyl)ethyl]-3H-1,4-benzodiazepin-3-yl]-2-thiophen-3-yl-propanamide

Systemtic Name: 3-(3,4-dichlorophenyl)-N-[2-oxidanylidene-5-phenyl-1-[2,2,2-tris(fluoranyl)ethyl]-3H-1,4-benzodiazepin-3-yl]-2-thiophen-3-yl-propanamide Openeye Name: 3-(3,4-dichlorophenyl)-N-[2-oxo-5-phenyl-1-(2,2,2-trifluoroethyl)-3H-1,4-benzodiazepin-3-yl]-2-(3-thienyl)propanamide CAS Name: 3-(3,4-dichlorophenyl)-N-[2-oxo-5-phenyl-1-(2,2,2-trifluoroethyl)-3H-1,4-benzodiazepin-3-yl]-2-(3-thiophenyl)propanamide IUPAC Name: 3-(3,4-dichlorophenyl)-N-[2-oxo-5-phenyl-1-(2,2,2-trifluoroethyl)-3H-1,4-benzodiazepin-3-yl]-2-thiophen-3-ylpropanamide Traditional Name: 3-(3,4-dichlorophenyl)-N-[2-keto-5-phenyl-1-(2,2,2-trifluoroethyl)-3H-1,4-benzodiazepin-3-yl]-2-(3-thienyl)propionamide Formula: C30H22Cl2F3N3O2S MolecularWeight: 616.48079

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(C(=O)N(C3=CC=CC=C32)CC(F)(F)F)NC(=O)C(CC4=CC(=C(C=C4)Cl)Cl)C5=CSC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(C(=O)N(C3=CC=CC=C32)CC(F)(F)F)NC(=O)C(CC4=CC(=C(C=C4)Cl)Cl)C5=CSC=C5

InChI

InChI=1S/C30H22Cl2F3N3O2S/c31-23-11-10-18(15-24(23)32)14-22(20-12-13-41-16-20)28(39)37-27-29(40)38(17-30(33,34)35)25-9-5-4-8-21(25)26(36-27)19-6-2-1-3-7-19/h1-13,15-16,22,27H,14,17H2,(H,37,39)