(4R,4aR)-2-ethylsulfanyl-4-(4-methylphenyl)-5-oxidanylidene-4,4a,6,7-tetrahydro-3H-quinoline-3-carbonitrile

Systemtic Name: (4R,4aR)-2-ethylsulfanyl-4-(4-methylphenyl)-5-oxidanylidene-4,4a,6,7-tetrahydro-3H-quinoline-3-carbonitrile Openeye Name: (4R,4aR)-2-ethylsulfanyl-5-oxo-4-(p-tolyl)-4,4a,6,7-tetrahydro-3H-quinoline-3-carbonitrile CAS Name: (4R,4aR)-2-(ethylthio)-4-(4-methylphenyl)-5-oxo-4,4a,6,7-tetrahydro-3H-quinoline-3-carbonitrile IUPAC Name: (4R,4aR)-2-ethylsulfanyl-4-(4-methylphenyl)-5-oxo-4,4a,6,7-tetrahydro-3H-quinoline-3-carbonitrile Traditional Name: (4R,4aR)-2-(ethylthio)-5-keto-4-(p-tolyl)-4,4a,6,7-tetrahydro-3H-quinoline-3-carbonitrile Formula: C19H20N2OS MolecularWeight: 324.4399

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=CCCC(=O)C2C(C1C#N)C3=CC=C(C=C3)C

Isomeric SMILES

CCSC1=NC2=CCCC(=O)[C@@H]2[C@H](C1C#N)C3=CC=C(C=C3)C

InChI

InChI=1S/C19H20N2OS/c1-3-23-19-14(11-20)17(13-9-7-12(2)8-10-13)18-15(21-19)5-4-6-16(18)22/h5,7-10,14,17-18H,3-4,6H2,1-2H3/t14?,17-,18+/m0/s1