2-[2,4-bis(trifluoromethyl)phenyl]-N-(1-ethyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)ethanamide

Systemtic Name: 2-[2,4-bis(trifluoromethyl)phenyl]-N-(1-ethyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)ethanamide Openeye Name: 2-[2,4-bis(trifluoromethyl)phenyl]-N-(1-ethyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)acetamide CAS Name: 2-[2,4-bis(trifluoromethyl)phenyl]-N-(1-ethyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)acetamide IUPAC Name: 2-[2,4-bis(trifluoromethyl)phenyl]-N-(1-ethyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)acetamide Traditional Name: 2-[2,4-bis(trifluoromethyl)phenyl]-N-(1-ethyl-2-keto-5-phenyl-3H-1,4-benzodiazepin-3-yl)acetamide Formula: C27H21F6N3O2 MolecularWeight: 533.464959

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)CC3=C(C=C(C=C3)C(F)(F)F)C(F)(F)F)C4=CC=CC=C4

Isomeric SMILES

CCN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)CC3=C(C=C(C=C3)C(F)(F)F)C(F)(F)F)C4=CC=CC=C4

InChI

InChI=1S/C27H21F6N3O2/c1-2-36-21-11-7-6-10-19(21)23(16-8-4-3-5-9-16)35-24(25(36)38)34-22(37)14-17-12-13-18(26(28,29)30)15-20(17)27(31,32)33/h3-13,15,24H,2,14H2,1H3,(H,34,37)