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

Systemtic Name: 5-chloranyl-3-methyl-N-[[1-(1-pyridin-4-ylpiperidin-4-yl)carbonylpyrrolidin-3-yl]methyl]-1-benzothiophene-2-sulfonamide Openeye Name: 5-chloro-3-methyl-N-[[1-[1-(4-pyridyl)piperidine-4-carbonyl]pyrrolidin-3-yl]methyl]benzothiophene-2-sulfonamide CAS Name: 5-chloro-3-methyl-N-[[1-[oxo-(1-pyridin-4-yl-4-piperidinyl)methyl]-3-pyrrolidinyl]methyl]-1-benzothiophene-2-sulfonamide IUPAC Name: 5-chloro-3-methyl-N-[[1-(1-pyridin-4-ylpiperidine-4-carbonyl)pyrrolidin-3-yl]methyl]-1-benzothiophene-2-sulfonamide Traditional Name: 5-chloro-3-methyl-N-[[1-[1-(4-pyridyl)isonipecotoyl]pyrrolidin-3-yl]methyl]benzothiophene-2-sulfonamide Formula: C25H29ClN4O3S2 MolecularWeight: 533.10576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)Cl)S(=O)(=O)NCC3CCN(C3)C(=O)C4CCN(CC4)C5=CC=NC=C5

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)Cl)S(=O)(=O)NCC3CCN(C3)C(=O)C4CCN(CC4)C5=CC=NC=C5

InChI

InChI=1S/C25H29ClN4O3S2/c1-17-22-14-20(26)2-3-23(22)34-25(17)35(32,33)28-15-18-6-11-30(16-18)24(31)19-7-12-29(13-8-19)21-4-9-27-10-5-21/h2-5,9-10,14,18-19,28H,6-8,11-13,15-16H2,1H3