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

Systemtic Name: N-[2-[3-(2-azanyl-2-oxidanylidene-ethyl)sulfanylindol-1-yl]ethyl]-3-(trifluoromethyl)benzamide Openeye Name: N-[2-[3-(2-amino-2-oxo-ethyl)sulfanylindol-1-yl]ethyl]-3-(trifluoromethyl)benzamide CAS Name: N-[2-[3-[(2-amino-2-oxoethyl)thio]-1-indolyl]ethyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[2-[3-(2-amino-2-oxoethyl)sulfanylindol-1-yl]ethyl]-3-(trifluoromethyl)benzamide Traditional Name: N-[2-[3-[(2-amino-2-keto-ethyl)thio]indol-1-yl]ethyl]-3-(trifluoromethyl)benzamide Formula: C20H18F3N3O2S MolecularWeight: 421.43603

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CCNC(=O)C3=CC(=CC=C3)C(F)(F)F)SCC(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CCNC(=O)C3=CC(=CC=C3)C(F)(F)F)SCC(=O)N

InChI

InChI=1S/C20H18F3N3O2S/c21-20(22,23)14-5-3-4-13(10-14)19(28)25-8-9-26-11-17(29-12-18(24)27)15-6-1-2-7-16(15)26/h1-7,10-11H,8-9,12H2,(H2,24,27)(H,25,28)