(6R)-2-butylsulfanyl-6-methyl-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: (6R)-2-butylsulfanyl-6-methyl-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: (6R)-2-butylsulfanyl-6-methyl-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: (6R)-2-(butylthio)-6-methyl-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: (6R)-2-butylsulfanyl-6-methyl-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: (6R)-2-(butylthio)-6-methyl-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C16H19F3N2S MolecularWeight: 328.39567

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC2=C(CC(CC2)C)C(=C1C#N)C(F)(F)F

Isomeric SMILES

CCCCSC1=NC2=C(C[C@@H](CC2)C)C(=C1C#N)C(F)(F)F

InChI

InChI=1S/C16H19F3N2S/c1-3-4-7-22-15-12(9-20)14(16(17,18)19)11-8-10(2)5-6-13(11)21-15/h10H,3-8H2,1-2H3/t10-/m1/s1