5,8-dimethyl-2-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-quinoline-3-carbonitrile

Systemtic Name: 5,8-dimethyl-2-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-quinoline-3-carbonitrile Openeye Name: 5,8-dimethyl-2-[2-(4-methyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-quinoline-3-carbonitrile CAS Name: 5,8-dimethyl-2-[[2-(4-methyl-1-piperidinyl)-2-oxoethyl]thio]-3-quinolinecarbonitrile IUPAC Name: 5,8-dimethyl-2-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanylquinoline-3-carbonitrile Traditional Name: 2-[[2-keto-2-(4-methylpiperidino)ethyl]thio]-5,8-dimethyl-quinoline-3-carbonitrile Formula: C20H23N3OS MolecularWeight: 353.48112

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CSC2=NC3=C(C=CC(=C3C=C2C#N)C)C

Isomeric SMILES

CC1CCN(CC1)C(=O)CSC2=NC3=C(C=CC(=C3C=C2C#N)C)C

InChI

InChI=1S/C20H23N3OS/c1-13-6-8-23(9-7-13)18(24)12-25-20-16(11-21)10-17-14(2)4-5-15(3)19(17)22-20/h4-5,10,13H,6-9,12H2,1-3H3