2-(2-oxidanylidene-2-thiophen-2-yl-ethyl)sulfanyl-4-pyridin-4-yl-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-(2-oxidanylidene-2-thiophen-2-yl-ethyl)sulfanyl-4-pyridin-4-yl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-[2-oxo-2-(2-thienyl)ethyl]sulfanyl-4-(4-pyridyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-[(2-oxo-2-thiophen-2-ylethyl)thio]-4-pyridin-4-yl-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-(2-oxo-2-thiophen-2-ylethyl)sulfanyl-4-pyridin-4-yl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-[[2-keto-2-(2-thienyl)ethyl]thio]-4-(4-pyridyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C21H17N3OS2 MolecularWeight: 391.50918

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(C(=N2)SCC(=O)C3=CC=CS3)C#N)C4=CC=NC=C4

Isomeric SMILES

C1CCC2=C(C1)C(=C(C(=N2)SCC(=O)C3=CC=CS3)C#N)C4=CC=NC=C4

InChI

InChI=1S/C21H17N3OS2/c22-12-16-20(14-7-9-23-10-8-14)15-4-1-2-5-17(15)24-21(16)27-13-18(25)19-6-3-11-26-19/h3,6-11H,1-2,4-5,13H2