(6S)-6-tert-butyl-2-ethylsulfanyl-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: (6S)-6-tert-butyl-2-ethylsulfanyl-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: (6S)-6-tert-butyl-2-ethylsulfanyl-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: (6S)-6-tert-butyl-2-(ethylthio)-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: (6S)-6-tert-butyl-2-ethylsulfanyl-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: (6S)-6-tert-butyl-2-(ethylthio)-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C17H21F3N2S MolecularWeight: 342.42225

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=C(CC(CC2)C(C)(C)C)C(=C1C#N)C(F)(F)F

Isomeric SMILES

CCSC1=NC2=C(C[C@H](CC2)C(C)(C)C)C(=C1C#N)C(F)(F)F

InChI

InChI=1S/C17H21F3N2S/c1-5-23-15-12(9-21)14(17(18,19)20)11-8-10(16(2,3)4)6-7-13(11)22-15/h10H,5-8H2,1-4H3/t10-/m0/s1