N-[[(3S)-1-[3-(1-methylpyrazol-4-yl)propanoyl]piperidin-3-yl]methyl]thiophene-2-sulfonamide

Systemtic Name: N-[[(3S)-1-[3-(1-methylpyrazol-4-yl)propanoyl]piperidin-3-yl]methyl]thiophene-2-sulfonamide Openeye Name: N-[[(3S)-1-[3-(1-methylpyrazol-4-yl)propanoyl]-3-piperidyl]methyl]thiophene-2-sulfonamide CAS Name: N-[[(3S)-1-[3-(1-methyl-4-pyrazolyl)-1-oxopropyl]-3-piperidinyl]methyl]-2-thiophenesulfonamide IUPAC Name: N-[[(3S)-1-[3-(1-methylpyrazol-4-yl)propanoyl]piperidin-3-yl]methyl]thiophene-2-sulfonamide Traditional Name: N-[[(3S)-1-[3-(1-methylpyrazol-4-yl)propanoyl]-3-piperidyl]methyl]thiophene-2-sulfonamide Formula: C17H24N4O3S2 MolecularWeight: 396.52746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CCC(=O)N2CCCC(C2)CNS(=O)(=O)C3=CC=CS3

Isomeric SMILES

CN1C=C(C=N1)CCC(=O)N2CCC[C@@H](C2)CNS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C17H24N4O3S2/c1-20-12-15(10-18-20)6-7-16(22)21-8-2-4-14(13-21)11-19-26(23,24)17-5-3-9-25-17/h3,5,9-10,12,14,19H,2,4,6-8,11,13H2,1H3/t14-/m1/s1