1-(cyanomethyl)-2-(1-ethylsulfanyl-2-oxidanyl-propan-2-yl)-6-(trifluoromethyl)indole-5-carbonitrile

Systemtic Name: 1-(cyanomethyl)-2-(1-ethylsulfanyl-2-oxidanyl-propan-2-yl)-6-(trifluoromethyl)indole-5-carbonitrile Openeye Name: 1-(cyanomethyl)-2-(2-ethylsulfanyl-1-hydroxy-1-methyl-ethyl)-6-(trifluoromethyl)indole-5-carbonitrile CAS Name: 1-(cyanomethyl)-2-[1-(ethylthio)-2-hydroxypropan-2-yl]-6-(trifluoromethyl)-5-indolecarbonitrile IUPAC Name: 1-(cyanomethyl)-2-(1-ethylsulfanyl-2-hydroxypropan-2-yl)-6-(trifluoromethyl)indole-5-carbonitrile Traditional Name: 1-(cyanomethyl)-2-[2-(ethylthio)-1-hydroxy-1-methyl-ethyl]-6-(trifluoromethyl)indole-5-carbonitrile Formula: C17H16F3N3OS MolecularWeight: 367.38865

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Descriptors Computed from Structure

Canonical SMILES:

CCSCC(C)(C1=CC2=C(N1CC#N)C=C(C(=C2)C#N)C(F)(F)F)O

Isomeric SMILES

CCSCC(C)(C1=CC2=C(N1CC#N)C=C(C(=C2)C#N)C(F)(F)F)O

InChI

InChI=1S/C17H16F3N3OS/c1-3-25-10-16(2,24)15-7-11-6-12(9-22)13(17(18,19)20)8-14(11)23(15)5-4-21/h6-8,24H,3,5,10H2,1-2H3