[1-[2-(3,4-dimethylphenyl)sulfanylpyridin-3-yl]carbonylpiperidin-4-yl]-morpholin-4-yl-methanone

Systemtic Name: [1-[2-(3,4-dimethylphenyl)sulfanylpyridin-3-yl]carbonylpiperidin-4-yl]-morpholin-4-yl-methanone Openeye Name: [1-[2-(3,4-dimethylphenyl)sulfanylpyridine-3-carbonyl]-4-piperidyl]-morpholino-methanone CAS Name: [1-[[2-[(3,4-dimethylphenyl)thio]-3-pyridinyl]-oxomethyl]-4-piperidinyl]-(4-morpholinyl)methanone IUPAC Name: [1-[2-(3,4-dimethylphenyl)sulfanylpyridine-3-carbonyl]piperidin-4-yl]-morpholin-4-ylmethanone Traditional Name: [1-[2-[(3,4-dimethylphenyl)thio]nicotinoyl]-4-piperidyl]-morpholino-methanone Formula: C24H29N3O3S MolecularWeight: 439.57036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC2=C(C=CC=N2)C(=O)N3CCC(CC3)C(=O)N4CCOCC4)C

Isomeric SMILES

CC1=C(C=C(C=C1)SC2=C(C=CC=N2)C(=O)N3CCC(CC3)C(=O)N4CCOCC4)C

InChI

InChI=1S/C24H29N3O3S/c1-17-5-6-20(16-18(17)2)31-22-21(4-3-9-25-22)24(29)26-10-7-19(8-11-26)23(28)27-12-14-30-15-13-27/h3-6,9,16,19H,7-8,10-15H2,1-2H3