2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-6-propan-2-yl-quinoline-3-carbonitrile

Systemtic Name: 2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-6-propan-2-yl-quinoline-3-carbonitrile Openeye Name: 6-isopropyl-2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-quinoline-3-carbonitrile CAS Name: 2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-6-propan-2-yl-3-quinolinecarbonitrile IUPAC Name: 2-(2-oxo-2-piperidin-1-ylethyl)sulfanyl-6-propan-2-ylquinoline-3-carbonitrile Traditional Name: 6-isopropyl-2-[(2-keto-2-piperidino-ethyl)thio]quinoline-3-carbonitrile Formula: C20H23N3OS MolecularWeight: 353.48112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)N3CCCCC3

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)N3CCCCC3

InChI

InChI=1S/C20H23N3OS/c1-14(2)15-6-7-18-16(10-15)11-17(12-21)20(22-18)25-13-19(24)23-8-4-3-5-9-23/h6-7,10-11,14H,3-5,8-9,13H2,1-2H3