N-[2-[3-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanylindol-1-yl]ethyl]-3-(trifluoromethyl)benzamide

Systemtic Name: N-[2-[3-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanylindol-1-yl]ethyl]-3-(trifluoromethyl)benzamide Openeye Name: N-[2-[3-(2-anilino-2-oxo-ethyl)sulfanylindol-1-yl]ethyl]-3-(trifluoromethyl)benzamide CAS Name: N-[2-[3-[(2-anilino-2-oxoethyl)thio]-1-indolyl]ethyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[2-[3-(2-anilino-2-oxoethyl)sulfanylindol-1-yl]ethyl]-3-(trifluoromethyl)benzamide Traditional Name: N-[2-[3-[(2-anilino-2-keto-ethyl)thio]indol-1-yl]ethyl]-3-(trifluoromethyl)benzamide Formula: C26H22F3N3O2S MolecularWeight: 497.53199

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H22F3N3O2S/c27-26(28,29)19-8-6-7-18(15-19)25(34)30-13-14-32-16-23(21-11-4-5-12-22(21)32)35-17-24(33)31-20-9-2-1-3-10-20/h1-12,15-16H,13-14,17H2,(H,30,34)(H,31,33)