N-[[(3S)-1-(1,5-dimethylpyrazol-3-yl)carbonylpiperidin-3-yl]methyl]thiophene-2-sulfonamide

Systemtic Name: N-[[(3S)-1-(1,5-dimethylpyrazol-3-yl)carbonylpiperidin-3-yl]methyl]thiophene-2-sulfonamide Openeye Name: N-[[(3S)-1-(1,5-dimethylpyrazole-3-carbonyl)-3-piperidyl]methyl]thiophene-2-sulfonamide CAS Name: N-[[(3S)-1-[(1,5-dimethyl-3-pyrazolyl)-oxomethyl]-3-piperidinyl]methyl]-2-thiophenesulfonamide IUPAC Name: N-[[(3S)-1-(1,5-dimethylpyrazole-3-carbonyl)piperidin-3-yl]methyl]thiophene-2-sulfonamide Traditional Name: N-[[(3S)-1-(1,5-dimethylpyrazole-3-carbonyl)-3-piperidyl]methyl]thiophene-2-sulfonamide Formula: C16H22N4O3S2 MolecularWeight: 382.50088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C)C(=O)N2CCCC(C2)CNS(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC(=NN1C)C(=O)N2CCC[C@@H](C2)CNS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C16H22N4O3S2/c1-12-9-14(18-19(12)2)16(21)20-7-3-5-13(11-20)10-17-25(22,23)15-6-4-8-24-15/h4,6,8-9,13,17H,3,5,7,10-11H2,1-2H3/t13-/m1/s1