N-[5-[cyclohexyl(methyl)amino]-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl]-3-[4-(trifluoromethyl)phenyl]propanamide

Systemtic Name: N-[5-[cyclohexyl(methyl)amino]-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl]-3-[4-(trifluoromethyl)phenyl]propanamide Openeye Name: N-[5-[cyclohexyl(methyl)amino]-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]-3-[4-(trifluoromethyl)phenyl]propanamide CAS Name: N-[5-[cyclohexyl(methyl)amino]-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]-3-[4-(trifluoromethyl)phenyl]propanamide IUPAC Name: N-[5-[cyclohexyl(methyl)amino]-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]-3-[4-(trifluoromethyl)phenyl]propanamide Traditional Name: N-[5-[cyclohexyl(methyl)amino]-2-keto-1-methyl-3H-1,4-benzodiazepin-3-yl]-3-[4-(trifluoromethyl)phenyl]propionamide Formula: C27H31F3N4O2 MolecularWeight: 500.55585

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)CCC3=CC=C(C=C3)C(F)(F)F)N(C)C4CCCCC4

Isomeric SMILES

CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)CCC3=CC=C(C=C3)C(F)(F)F)N(C)C4CCCCC4

InChI

InChI=1S/C27H31F3N4O2/c1-33(20-8-4-3-5-9-20)25-21-10-6-7-11-22(21)34(2)26(36)24(32-25)31-23(35)17-14-18-12-15-19(16-13-18)27(28,29)30/h6-7,10-13,15-16,20,24H,3-5,8-9,14,17H2,1-2H3,(H,31,35)