N-(3-piperidin-1-ylsulfonylphenyl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-piperidin-1-ylsulfonylphenyl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-[3-(1-piperidylsulfonyl)phenyl]-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-[3-(1-piperidinylsulfonyl)phenyl]-2-[(4,5,6-trimethyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-(3-piperidin-1-ylsulfonylphenyl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(3-piperidinosulfonylphenyl)-2-[(4,5,6-trimethylpyrimidin-2-yl)thio]acetamide Formula: C20H26N4O3S2 MolecularWeight: 434.57544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1C)SCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)C

Isomeric SMILES

CC1=C(N=C(N=C1C)SCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)C

InChI

InChI=1S/C20H26N4O3S2/c1-14-15(2)21-20(22-16(14)3)28-13-19(25)23-17-8-7-9-18(12-17)29(26,27)24-10-5-4-6-11-24/h7-9,12H,4-6,10-11,13H2,1-3H3,(H,23,25)