N-[2-(3,5-dimethylpiperidin-1-yl)carbonylphenyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-(3,5-dimethylpiperidin-1-yl)carbonylphenyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-[2-[(3,5-dimethyl-1-piperidinyl)-oxomethyl]phenyl]-2-[(4,6-dimethyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]-2-[(4,6-dimethylpyrimidin-2-yl)thio]acetamide Formula: C22H28N4O2S MolecularWeight: 412.54832

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)C2=CC=CC=C2NC(=O)CSC3=NC(=CC(=N3)C)C)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)C2=CC=CC=C2NC(=O)CSC3=NC(=CC(=N3)C)C)C

InChI

InChI=1S/C22H28N4O2S/c1-14-9-15(2)12-26(11-14)21(28)18-7-5-6-8-19(18)25-20(27)13-29-22-23-16(3)10-17(4)24-22/h5-8,10,14-15H,9,11-13H2,1-4H3,(H,25,27)