2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-4-thiophen-2-yl-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-4-thiophen-2-yl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-4-(2-thienyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-[2-(4-chlorophenyl)sulfonylethylthio]-4-thiophen-2-yl-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-4-thiophen-2-yl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-[2-(4-chlorophenyl)sulfonylethylthio]-4-(2-thienyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C22H19ClN2O2S3 MolecularWeight: 475.04646

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(C(=N2)SCCS(=O)(=O)C3=CC=C(C=C3)Cl)C#N)C4=CC=CS4

Isomeric SMILES

C1CCC2=C(C1)C(=C(C(=N2)SCCS(=O)(=O)C3=CC=C(C=C3)Cl)C#N)C4=CC=CS4

InChI

InChI=1S/C22H19ClN2O2S3/c23-15-7-9-16(10-8-15)30(26,27)13-12-29-22-18(14-24)21(20-6-3-11-28-20)17-4-1-2-5-19(17)25-22/h3,6-11H,1-2,4-5,12-13H2