N-[[(3S)-1-[2-(benzimidazol-1-yl)ethanoyl]piperidin-3-yl]methyl]-4-methoxy-benzenesulfonamide

Systemtic Name: N-[[(3S)-1-[2-(benzimidazol-1-yl)ethanoyl]piperidin-3-yl]methyl]-4-methoxy-benzenesulfonamide Openeye Name: N-[[(3S)-1-[2-(benzimidazol-1-yl)acetyl]-3-piperidyl]methyl]-4-methoxy-benzenesulfonamide CAS Name: N-[[(3S)-1-[2-(1-benzimidazolyl)-1-oxoethyl]-3-piperidinyl]methyl]-4-methoxybenzenesulfonamide IUPAC Name: N-[[(3S)-1-[2-(benzimidazol-1-yl)acetyl]piperidin-3-yl]methyl]-4-methoxybenzenesulfonamide Traditional Name: N-[[(3S)-1-[2-(benzimidazol-1-yl)acetyl]-3-piperidyl]methyl]-4-methoxy-benzenesulfonamide Formula: C22H26N4O4S MolecularWeight: 442.53124

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NCC2CCCN(C2)C(=O)CN3C=NC4=CC=CC=C43

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NC[C@H]2CCCN(C2)C(=O)CN3C=NC4=CC=CC=C43

InChI

InChI=1S/C22H26N4O4S/c1-30-18-8-10-19(11-9-18)31(28,29)24-13-17-5-4-12-25(14-17)22(27)15-26-16-23-20-6-2-3-7-21(20)26/h2-3,6-11,16-17,24H,4-5,12-15H2,1H3/t17-/m1/s1