2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-7-methoxy-quinoline-3-carbonitrile

Systemtic Name: 2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-7-methoxy-quinoline-3-carbonitrile Openeye Name: 2-[2-(4-chlorophenyl)-2-oxo-ethyl]sulfanyl-7-methoxy-quinoline-3-carbonitrile CAS Name: 2-[[2-(4-chlorophenyl)-2-oxoethyl]thio]-7-methoxy-3-quinolinecarbonitrile IUPAC Name: 2-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-7-methoxyquinoline-3-carbonitrile Traditional Name: 2-[[2-(4-chlorophenyl)-2-keto-ethyl]thio]-7-methoxy-quinoline-3-carbonitrile Formula: C19H13ClN2O2S MolecularWeight: 368.83672

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C(=N2)SCC(=O)C3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C(=N2)SCC(=O)C3=CC=C(C=C3)Cl)C#N

InChI

InChI=1S/C19H13ClN2O2S/c1-24-16-7-4-13-8-14(10-21)19(22-17(13)9-16)25-11-18(23)12-2-5-15(20)6-3-12/h2-9H,11H2,1H3