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

Systemtic Name: 1-ethyl-2-(1-ethylsulfanyl-2-oxidanyl-propan-2-yl)-6-(trifluoromethyl)indole-5-carbonitrile Openeye Name: 1-ethyl-2-(2-ethylsulfanyl-1-hydroxy-1-methyl-ethyl)-6-(trifluoromethyl)indole-5-carbonitrile CAS Name: 1-ethyl-2-[1-(ethylthio)-2-hydroxypropan-2-yl]-6-(trifluoromethyl)-5-indolecarbonitrile IUPAC Name: 1-ethyl-2-(1-ethylsulfanyl-2-hydroxypropan-2-yl)-6-(trifluoromethyl)indole-5-carbonitrile Traditional Name: 1-ethyl-2-[2-(ethylthio)-1-hydroxy-1-methyl-ethyl]-6-(trifluoromethyl)indole-5-carbonitrile Formula: C17H19F3N2OS MolecularWeight: 356.40577

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC2=C1C=C(C(=C2)C#N)C(F)(F)F)C(C)(CSCC)O

Isomeric SMILES

CCN1C(=CC2=C1C=C(C(=C2)C#N)C(F)(F)F)C(C)(CSCC)O

InChI

InChI=1S/C17H19F3N2OS/c1-4-22-14-8-13(17(18,19)20)12(9-21)6-11(14)7-15(22)16(3,23)10-24-5-2/h6-8,23H,4-5,10H2,1-3H3