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

Systemtic Name: 2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-7-methyl-quinoline-3-carbonitrile Openeye Name: 2-[2-(4-chlorophenyl)-2-oxo-ethyl]sulfanyl-7-methyl-quinoline-3-carbonitrile CAS Name: 2-[[2-(4-chlorophenyl)-2-oxoethyl]thio]-7-methyl-3-quinolinecarbonitrile IUPAC Name: 2-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-7-methylquinoline-3-carbonitrile Traditional Name: 2-[[2-(4-chlorophenyl)-2-keto-ethyl]thio]-7-methyl-quinoline-3-carbonitrile Formula: C19H13ClN2OS MolecularWeight: 352.83732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=N2)SCC(=O)C3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=N2)SCC(=O)C3=CC=C(C=C3)Cl)C#N

InChI

InChI=1S/C19H13ClN2OS/c1-12-2-3-14-9-15(10-21)19(22-17(14)8-12)24-11-18(23)13-4-6-16(20)7-5-13/h2-9H,11H2,1H3