(4R,4aR)-4-ethyl-7,7-dimethyl-2-methylsulfanyl-5-oxidanylidene-4,4a,6,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: (4R,4aR)-4-ethyl-7,7-dimethyl-2-methylsulfanyl-5-oxidanylidene-4,4a,6,8-tetrahydroquinoline-3-carbonitrile Openeye Name: (4R,4aR)-4-ethyl-7,7-dimethyl-2-methylsulfanyl-5-oxo-4,4a,6,8-tetrahydroquinoline-3-carbonitrile CAS Name: (4R,4aR)-4-ethyl-7,7-dimethyl-2-(methylthio)-5-oxo-4,4a,6,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: (4R,4aR)-4-ethyl-7,7-dimethyl-2-methylsulfanyl-5-oxo-4,4a,6,8-tetrahydroquinoline-3-carbonitrile Traditional Name: (4R,4aR)-4-ethyl-5-keto-7,7-dimethyl-2-(methylthio)-4,4a,6,8-tetrahydroquinoline-3-carbonitrile Formula: C15H20N2OS MolecularWeight: 276.3971

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C2C(=NC(=C1C#N)SC)CC(CC2=O)(C)C

Isomeric SMILES

CC[C@@H]1[C@@H]2C(=NC(=C1C#N)SC)CC(CC2=O)(C)C

InChI

InChI=1S/C15H20N2OS/c1-5-9-10(8-16)14(19-4)17-11-6-15(2,3)7-12(18)13(9)11/h9,13H,5-7H2,1-4H3/t9-,13+/m0/s1