N-[1-[(2-methylsulfonylphenyl)methyl]piperidin-4-yl]-N-(pyridin-3-ylmethyl)thiophene-2-sulfonamide

Systemtic Name: N-[1-[(2-methylsulfonylphenyl)methyl]piperidin-4-yl]-N-(pyridin-3-ylmethyl)thiophene-2-sulfonamide Openeye Name: N-[1-[(2-methylsulfonylphenyl)methyl]-4-piperidyl]-N-(3-pyridylmethyl)thiophene-2-sulfonamide CAS Name: N-[1-[(2-methylsulfonylphenyl)methyl]-4-piperidinyl]-N-(3-pyridinylmethyl)-2-thiophenesulfonamide IUPAC Name: N-[1-[(2-methylsulfonylphenyl)methyl]piperidin-4-yl]-N-(pyridin-3-ylmethyl)thiophene-2-sulfonamide Traditional Name: N-[1-(2-mesylbenzyl)-4-piperidyl]-N-(3-pyridylmethyl)thiophene-2-sulfonamide Formula: C23H27N3O4S3 MolecularWeight: 505.67318

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1CN2CCC(CC2)N(CC3=CN=CC=C3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1CN2CCC(CC2)N(CC3=CN=CC=C3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C23H27N3O4S3/c1-32(27,28)22-8-3-2-7-20(22)18-25-13-10-21(11-14-25)26(17-19-6-4-12-24-16-19)33(29,30)23-9-5-15-31-23/h2-9,12,15-16,21H,10-11,13-14,17-18H2,1H3