N-(2-methoxyethyl)-N-[1-[(2-methylsulfonylphenyl)methyl]piperidin-4-yl]thiophene-2-sulfonamide

Systemtic Name: N-(2-methoxyethyl)-N-[1-[(2-methylsulfonylphenyl)methyl]piperidin-4-yl]thiophene-2-sulfonamide Openeye Name: N-(2-methoxyethyl)-N-[1-[(2-methylsulfonylphenyl)methyl]-4-piperidyl]thiophene-2-sulfonamide CAS Name: N-(2-methoxyethyl)-N-[1-[(2-methylsulfonylphenyl)methyl]-4-piperidinyl]-2-thiophenesulfonamide IUPAC Name: N-(2-methoxyethyl)-N-[1-[(2-methylsulfonylphenyl)methyl]piperidin-4-yl]thiophene-2-sulfonamide Traditional Name: N-[1-(2-mesylbenzyl)-4-piperidyl]-N-(2-methoxyethyl)thiophene-2-sulfonamide Formula: C20H28N2O5S3 MolecularWeight: 472.64172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCN(C1CCN(CC1)CC2=CC=CC=C2S(=O)(=O)C)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

COCCN(C1CCN(CC1)CC2=CC=CC=C2S(=O)(=O)C)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C20H28N2O5S3/c1-27-14-13-22(30(25,26)20-8-5-15-28-20)18-9-11-21(12-10-18)16-17-6-3-4-7-19(17)29(2,23)24/h3-8,15,18H,9-14,16H2,1-2H3