N-[3-(4,5-diphenyl-1-propyl-imidazol-2-yl)sulfanylpropyl]-3,5-bis(trifluoromethyl)benzamide

Systemtic Name: N-[3-(4,5-diphenyl-1-propyl-imidazol-2-yl)sulfanylpropyl]-3,5-bis(trifluoromethyl)benzamide Openeye Name: N-[3-(4,5-diphenyl-1-propyl-imidazol-2-yl)sulfanylpropyl]-3,5-bis(trifluoromethyl)benzamide CAS Name: N-[3-[(4,5-diphenyl-1-propyl-2-imidazolyl)thio]propyl]-3,5-bis(trifluoromethyl)benzamide IUPAC Name: N-[3-(4,5-diphenyl-1-propylimidazol-2-yl)sulfanylpropyl]-3,5-bis(trifluoromethyl)benzamide Traditional Name: N-[3-[(4,5-diphenyl-1-propyl-imidazol-2-yl)thio]propyl]-3,5-bis(trifluoromethyl)benzamide Formula: C30H27F6N3OS MolecularWeight: 591.610299

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(N=C1SCCCNC(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCN1C(=C(N=C1SCCCNC(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C30H27F6N3OS/c1-2-15-39-26(21-12-7-4-8-13-21)25(20-10-5-3-6-11-20)38-28(39)41-16-9-14-37-27(40)22-17-23(29(31,32)33)19-24(18-22)30(34,35)36/h3-8,10-13,17-19H,2,9,14-16H2,1H3,(H,37,40)