4-methoxy-N-[[(3S)-1-[3-(1-methylpyrazol-4-yl)propanoyl]piperidin-3-yl]methyl]benzenesulfonamide

Systemtic Name: 4-methoxy-N-[[(3S)-1-[3-(1-methylpyrazol-4-yl)propanoyl]piperidin-3-yl]methyl]benzenesulfonamide Openeye Name: 4-methoxy-N-[[(3S)-1-[3-(1-methylpyrazol-4-yl)propanoyl]-3-piperidyl]methyl]benzenesulfonamide CAS Name: 4-methoxy-N-[[(3S)-1-[3-(1-methyl-4-pyrazolyl)-1-oxopropyl]-3-piperidinyl]methyl]benzenesulfonamide IUPAC Name: 4-methoxy-N-[[(3S)-1-[3-(1-methylpyrazol-4-yl)propanoyl]piperidin-3-yl]methyl]benzenesulfonamide Traditional Name: 4-methoxy-N-[[(3S)-1-[3-(1-methylpyrazol-4-yl)propanoyl]-3-piperidyl]methyl]benzenesulfonamide Formula: C20H28N4O4S MolecularWeight: 420.52572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28N4O4S/c1-23-14-17(12-21-23)5-10-20(25)24-11-3-4-16(15-24)13-22-29(26,27)19-8-6-18(28-2)7-9-19/h6-9,12,14,16,22H,3-5,10-11,13,15H2,1-2H3/t16-/m1/s1