5,8-dimethyl-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-quinoline-3-carbonitrile

Systemtic Name: 5,8-dimethyl-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-quinoline-3-carbonitrile Openeye Name: 5,8-dimethyl-2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-quinoline-3-carbonitrile CAS Name: 5,8-dimethyl-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-3-quinolinecarbonitrile IUPAC Name: 5,8-dimethyl-2-(2-oxo-2-piperidin-1-ylethyl)sulfanylquinoline-3-carbonitrile Traditional Name: 2-[(2-keto-2-piperidino-ethyl)thio]-5,8-dimethyl-quinoline-3-carbonitrile Formula: C19H21N3OS MolecularWeight: 339.45454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=NC2=C(C=C1)C)SCC(=O)N3CCCCC3)C#N

Isomeric SMILES

CC1=C2C=C(C(=NC2=C(C=C1)C)SCC(=O)N3CCCCC3)C#N

InChI

InChI=1S/C19H21N3OS/c1-13-6-7-14(2)18-16(13)10-15(11-20)19(21-18)24-12-17(23)22-8-4-3-5-9-22/h6-7,10H,3-5,8-9,12H2,1-2H3