N-[[1-(2,6-dimethylpyrimidin-4-yl)carbonylpiperidin-3-yl]methyl]thiophene-2-sulfonamide

Systemtic Name: N-[[1-(2,6-dimethylpyrimidin-4-yl)carbonylpiperidin-3-yl]methyl]thiophene-2-sulfonamide Openeye Name: N-[[1-(2,6-dimethylpyrimidine-4-carbonyl)-3-piperidyl]methyl]thiophene-2-sulfonamide CAS Name: N-[[1-[(2,6-dimethyl-4-pyrimidinyl)-oxomethyl]-3-piperidinyl]methyl]-2-thiophenesulfonamide IUPAC Name: N-[[1-(2,6-dimethylpyrimidine-4-carbonyl)piperidin-3-yl]methyl]thiophene-2-sulfonamide Traditional Name: N-[[1-(2,6-dimethylpyrimidine-4-carbonyl)-3-piperidyl]methyl]thiophene-2-sulfonamide Formula: C17H22N4O3S2 MolecularWeight: 394.51158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C(=O)N2CCCC(C2)CNS(=O)(=O)C3=CC=CS3)C

Isomeric SMILES

CC1=NC(=NC(=C1)C(=O)N2CCCC(C2)CNS(=O)(=O)C3=CC=CS3)C

InChI

InChI=1S/C17H22N4O3S2/c1-12-9-15(20-13(2)19-12)17(22)21-7-3-5-14(11-21)10-18-26(23,24)16-6-4-8-25-16/h4,6,8-9,14,18H,3,5,7,10-11H2,1-2H3