(3S,4R)-4-(2-chlorophenyl)-2-oxidanylidene-6-sulfanyl-3,4-dihydro-1H-pyridine-3,5-dicarbonitrile

Systemtic Name: (3S,4R)-4-(2-chlorophenyl)-2-oxidanylidene-6-sulfanyl-3,4-dihydro-1H-pyridine-3,5-dicarbonitrile Openeye Name: (3S,4R)-4-(2-chlorophenyl)-2-oxo-6-sulfanyl-3,4-dihydro-1H-pyridine-3,5-dicarbonitrile CAS Name: (3S,4R)-4-(2-chlorophenyl)-6-mercapto-2-oxo-3,4-dihydro-1H-pyridine-3,5-dicarbonitrile IUPAC Name: (3S,4R)-4-(2-chlorophenyl)-2-oxo-6-sulfanyl-3,4-dihydro-1H-pyridine-3,5-dicarbonitrile Traditional Name: (3S,4R)-4-(2-chlorophenyl)-2-keto-6-mercapto-3,4-dihydro-1H-pyridine-3,5-dicarbonitrile Formula: C13H8ClN3OS MolecularWeight: 289.74012

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2C(C(=O)NC(=C2C#N)S)C#N)Cl

Isomeric SMILES

C1=CC=C(C(=C1)[C@@H]2[C@H](C(=O)NC(=C2C#N)S)C#N)Cl

InChI

InChI=1S/C13H8ClN3OS/c14-10-4-2-1-3-7(10)11-8(5-15)12(18)17-13(19)9(11)6-16/h1-4,8,11,19H,(H,17,18)/t8-,11-/m1/s1