1-[2-(3,4-dimethylphenyl)sulfanylpyridin-3-yl]carbonylpiperidine-4-carboxamide

Systemtic Name: 1-[2-(3,4-dimethylphenyl)sulfanylpyridin-3-yl]carbonylpiperidine-4-carboxamide Openeye Name: 1-[2-(3,4-dimethylphenyl)sulfanylpyridine-3-carbonyl]piperidine-4-carboxamide CAS Name: 1-[[2-[(3,4-dimethylphenyl)thio]-3-pyridinyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-(3,4-dimethylphenyl)sulfanylpyridine-3-carbonyl]piperidine-4-carboxamide Traditional Name: 1-[2-[(3,4-dimethylphenyl)thio]nicotinoyl]isonipecotamide Formula: C20H23N3O2S MolecularWeight: 369.48052

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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)N)C

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O2S/c1-13-5-6-16(12-14(13)2)26-19-17(4-3-9-22-19)20(25)23-10-7-15(8-11-23)18(21)24/h3-6,9,12,15H,7-8,10-11H2,1-2H3,(H2,21,24)