5-chloranyl-N-[[(3R)-1-(1-pyridin-4-ylpiperidin-4-yl)carbonylpyrrolidin-3-yl]methyl]-1-benzothiophene-2-sulfonamide

Systemtic Name: 5-chloranyl-N-[[(3R)-1-(1-pyridin-4-ylpiperidin-4-yl)carbonylpyrrolidin-3-yl]methyl]-1-benzothiophene-2-sulfonamide Openeye Name: 5-chloro-N-[[(3R)-1-[1-(4-pyridyl)piperidine-4-carbonyl]pyrrolidin-3-yl]methyl]benzothiophene-2-sulfonamide CAS Name: 5-chloro-N-[[(3R)-1-[oxo-(1-pyridin-4-yl-4-piperidinyl)methyl]-3-pyrrolidinyl]methyl]-1-benzothiophene-2-sulfonamide IUPAC Name: 5-chloro-N-[[(3R)-1-(1-pyridin-4-ylpiperidine-4-carbonyl)pyrrolidin-3-yl]methyl]-1-benzothiophene-2-sulfonamide Traditional Name: 5-chloro-N-[[(3R)-1-[1-(4-pyridyl)isonipecotoyl]pyrrolidin-3-yl]methyl]benzothiophene-2-sulfonamide Formula: C24H27ClN4O3S2 MolecularWeight: 519.07918

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCC(C2)CNS(=O)(=O)C3=CC4=C(S3)C=CC(=C4)Cl)C5=CC=NC=C5

Isomeric SMILES

C1CN(C[C@@H]1CNS(=O)(=O)C2=CC3=C(S2)C=CC(=C3)Cl)C(=O)C4CCN(CC4)C5=CC=NC=C5

InChI

InChI=1S/C24H27ClN4O3S2/c25-20-1-2-22-19(13-20)14-23(33-22)34(31,32)27-15-17-5-10-29(16-17)24(30)18-6-11-28(12-7-18)21-3-8-26-9-4-21/h1-4,8-9,13-14,17-18,27H,5-7,10-12,15-16H2/t17-/m0/s1