(4R)-5-oxidanylidene-2-(phenylmethylsulfanyl)-4-thiophen-2-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carbonitrile

Systemtic Name: (4R)-5-oxidanylidene-2-(phenylmethylsulfanyl)-4-thiophen-2-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carbonitrile Openeye Name: (4R)-2-benzylsulfanyl-5-oxo-4-(2-thienyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carbonitrile CAS Name: (4R)-5-oxo-2-(phenylmethylthio)-4-thiophen-2-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carbonitrile IUPAC Name: (4R)-2-benzylsulfanyl-5-oxo-4-thiophen-2-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carbonitrile Traditional Name: (4R)-2-(benzylthio)-5-keto-4-(2-thienyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carbonitrile Formula: C21H18N2OS2 MolecularWeight: 378.51042

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(C(C(=N2)SCC3=CC=CC=C3)C#N)C4=CC=CS4)C(=O)C1

Isomeric SMILES

C1CC2=C([C@@H](C(C(=N2)SCC3=CC=CC=C3)C#N)C4=CC=CS4)C(=O)C1

InChI

InChI=1S/C21H18N2OS2/c22-12-15-19(18-10-5-11-25-18)20-16(8-4-9-17(20)24)23-21(15)26-13-14-6-2-1-3-7-14/h1-3,5-7,10-11,15,19H,4,8-9,13H2/t15?,19-/m0/s1