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

Systemtic Name: 2-[2-(3-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-pyridin-3-yl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-[2-(3-methoxyphenyl)-2-oxo-ethyl]sulfanyl-4-(3-pyridyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-[[2-(3-methoxyphenyl)-2-oxoethyl]thio]-4-(3-pyridinyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-[2-(3-methoxyphenyl)-2-oxoethyl]sulfanyl-4-pyridin-3-yl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-[[2-keto-2-(3-methoxyphenyl)ethyl]thio]-4-(3-pyridyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C24H21N3O2S MolecularWeight: 415.50744

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)CSC2=NC3=C(CCCC3)C(=C2C#N)C4=CN=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)CSC2=NC3=C(CCCC3)C(=C2C#N)C4=CN=CC=C4

InChI

InChI=1S/C24H21N3O2S/c1-29-18-8-4-6-16(12-18)22(28)15-30-24-20(13-25)23(17-7-5-11-26-14-17)19-9-2-3-10-21(19)27-24/h4-8,11-12,14H,2-3,9-10,15H2,1H3