N-[2-[3-(phenylmethylsulfanyl)indol-1-yl]ethyl]-3-(trifluoromethyl)benzamide

Systemtic Name: N-[2-[3-(phenylmethylsulfanyl)indol-1-yl]ethyl]-3-(trifluoromethyl)benzamide Openeye Name: N-[2-(3-benzylsulfanylindol-1-yl)ethyl]-3-(trifluoromethyl)benzamide CAS Name: N-[2-[3-(phenylmethylthio)-1-indolyl]ethyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[2-(3-benzylsulfanylindol-1-yl)ethyl]-3-(trifluoromethyl)benzamide Traditional Name: N-[2-[3-(benzylthio)indol-1-yl]ethyl]-3-(trifluoromethyl)benzamide Formula: C25H21F3N2OS MolecularWeight: 454.50725

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=CN(C3=CC=CC=C32)CCNC(=O)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CSC2=CN(C3=CC=CC=C32)CCNC(=O)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C25H21F3N2OS/c26-25(27,28)20-10-6-9-19(15-20)24(31)29-13-14-30-16-23(21-11-4-5-12-22(21)30)32-17-18-7-2-1-3-8-18/h1-12,15-16H,13-14,17H2,(H,29,31)