3-[3,5-bis(trifluoromethyl)phenyl]-N-[1-(2,2-dimethylpropyl)-2-oxidanylidene-4,5-dihydro-3H-1,4-benzodiazepin-3-yl]-N-[(2-fluorophenyl)methyl]-3-oxidanylidene-propanamide

Systemtic Name: 3-[3,5-bis(trifluoromethyl)phenyl]-N-[1-(2,2-dimethylpropyl)-2-oxidanylidene-4,5-dihydro-3H-1,4-benzodiazepin-3-yl]-N-[(2-fluorophenyl)methyl]-3-oxidanylidene-propanamide Openeye Name: 3-[3,5-bis(trifluoromethyl)phenyl]-N-[1-(2,2-dimethylpropyl)-2-oxo-4,5-dihydro-3H-1,4-benzodiazepin-3-yl]-N-[(2-fluorophenyl)methyl]-3-oxo-propanamide CAS Name: 3-[3,5-bis(trifluoromethyl)phenyl]-N-[1-(2,2-dimethylpropyl)-2-oxo-4,5-dihydro-3H-1,4-benzodiazepin-3-yl]-N-[(2-fluorophenyl)methyl]-3-oxopropanamide IUPAC Name: 3-[3,5-bis(trifluoromethyl)phenyl]-N-[1-(2,2-dimethylpropyl)-2-oxo-4,5-dihydro-3H-1,4-benzodiazepin-3-yl]-N-[(2-fluorophenyl)methyl]-3-oxopropanamide Traditional Name: 3-[3,5-bis(trifluoromethyl)phenyl]-N-(2-fluorobenzyl)-3-keto-N-(2-keto-1-neopentyl-4,5-dihydro-3H-1,4-benzodiazepin-3-yl)propionamide Formula: C32H30F7N3O3 MolecularWeight: 637.587722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CN1C2=CC=CC=C2CNC(C1=O)N(CC3=CC=CC=C3F)C(=O)CC(=O)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC(C)(C)CN1C2=CC=CC=C2CNC(C1=O)N(CC3=CC=CC=C3F)C(=O)CC(=O)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C32H30F7N3O3/c1-30(2,3)18-42-25-11-7-5-8-19(25)16-40-28(29(42)45)41(17-20-9-4-6-10-24(20)33)27(44)15-26(43)21-12-22(31(34,35)36)14-23(13-21)32(37,38)39/h4-14,28,40H,15-18H2,1-3H3