N-[1-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoyl]piperidin-4-yl]thiophene-2-sulfonamide

Systemtic Name: N-[1-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoyl]piperidin-4-yl]thiophene-2-sulfonamide Openeye Name: N-[1-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]-4-piperidyl]thiophene-2-sulfonamide CAS Name: N-[1-[2-[(4,6-dimethyl-2-pyrimidinyl)thio]-1-oxoethyl]-4-piperidinyl]-2-thiophenesulfonamide IUPAC Name: N-[1-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]piperidin-4-yl]thiophene-2-sulfonamide Traditional Name: N-[1-[2-[(4,6-dimethylpyrimidin-2-yl)thio]acetyl]-4-piperidyl]thiophene-2-sulfonamide Formula: C17H22N4O3S3 MolecularWeight: 426.57658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)N2CCC(CC2)NS(=O)(=O)C3=CC=CS3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)N2CCC(CC2)NS(=O)(=O)C3=CC=CS3)C

InChI

InChI=1S/C17H22N4O3S3/c1-12-10-13(2)19-17(18-12)26-11-15(22)21-7-5-14(6-8-21)20-27(23,24)16-4-3-9-25-16/h3-4,9-10,14,20H,5-8,11H2,1-2H3