2-butyl-3-(cyclopropylmethyl)-N'-[2-oxidanylidene-1-[[3-[4-(trifluoromethyl)phenyl]phenyl]methyl]azepan-3-yl]butanediamide

Systemtic Name: 2-butyl-3-(cyclopropylmethyl)-N'-[2-oxidanylidene-1-[[3-[4-(trifluoromethyl)phenyl]phenyl]methyl]azepan-3-yl]butanediamide Openeye Name: 2-butyl-3-(cyclopropylmethyl)-N'-[2-oxo-1-[[3-[4-(trifluoromethyl)phenyl]phenyl]methyl]azepan-3-yl]butanediamide CAS Name: 2-butyl-3-(cyclopropylmethyl)-N'-[2-oxo-1-[[3-[4-(trifluoromethyl)phenyl]phenyl]methyl]-3-azepanyl]butanediamide IUPAC Name: 2-butyl-3-(cyclopropylmethyl)-N'-[2-oxo-1-[[3-[4-(trifluoromethyl)phenyl]phenyl]methyl]azepan-3-yl]butanediamide Traditional Name: 2-butyl-3-(cyclopropylmethyl)-N'-[2-keto-1-[3-[4-(trifluoromethyl)phenyl]benzyl]azepan-3-yl]succinamide Formula: C32H40F3N3O3 MolecularWeight: 571.67351

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(CC1CC1)C(=O)NC2CCCCN(C2=O)CC3=CC=CC(=C3)C4=CC=C(C=C4)C(F)(F)F)C(=O)N

Isomeric SMILES

CCCCC(C(CC1CC1)C(=O)NC2CCCCN(C2=O)CC3=CC=CC(=C3)C4=CC=C(C=C4)C(F)(F)F)C(=O)N

InChI

InChI=1S/C32H40F3N3O3/c1-2-3-9-26(29(36)39)27(19-21-11-12-21)30(40)37-28-10-4-5-17-38(31(28)41)20-22-7-6-8-24(18-22)23-13-15-25(16-14-23)32(33,34)35/h6-8,13-16,18,21,26-28H,2-5,9-12,17,19-20H2,1H3,(H2,36,39)(H,37,40)