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

Systemtic Name: 6-methyl-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-quinoline-3-carbonitrile Openeye Name: 6-methyl-2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-quinoline-3-carbonitrile CAS Name: 6-methyl-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-3-quinolinecarbonitrile IUPAC Name: 6-methyl-2-(2-oxo-2-piperidin-1-ylethyl)sulfanylquinoline-3-carbonitrile Traditional Name: 2-[(2-keto-2-piperidino-ethyl)thio]-6-methyl-quinoline-3-carbonitrile Formula: C18H19N3OS MolecularWeight: 325.42796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)N3CCCCC3

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)N3CCCCC3

InChI

InChI=1S/C18H19N3OS/c1-13-5-6-16-14(9-13)10-15(11-19)18(20-16)23-12-17(22)21-7-3-2-4-8-21/h5-6,9-10H,2-4,7-8,12H2,1H3