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

Systemtic Name: N-[[(3S)-1-[3-(benzimidazol-1-yl)propanoyl]piperidin-3-yl]methyl]thiophene-2-sulfonamide Openeye Name: N-[[(3S)-1-[3-(benzimidazol-1-yl)propanoyl]-3-piperidyl]methyl]thiophene-2-sulfonamide CAS Name: N-[[(3S)-1-[3-(1-benzimidazolyl)-1-oxopropyl]-3-piperidinyl]methyl]-2-thiophenesulfonamide IUPAC Name: N-[[(3S)-1-[3-(benzimidazol-1-yl)propanoyl]piperidin-3-yl]methyl]thiophene-2-sulfonamide Traditional Name: N-[[(3S)-1-[3-(benzimidazol-1-yl)propanoyl]-3-piperidyl]methyl]thiophene-2-sulfonamide Formula: C20H24N4O3S2 MolecularWeight: 432.55956

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CCN2C=NC3=CC=CC=C32)CNS(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)CCN2C=NC3=CC=CC=C32)CNS(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C20H24N4O3S2/c25-19(9-11-24-15-21-17-6-1-2-7-18(17)24)23-10-3-5-16(14-23)13-22-29(26,27)20-8-4-12-28-20/h1-2,4,6-8,12,15-16,22H,3,5,9-11,13-14H2/t16-/m1/s1