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

Systemtic Name: N-(cyclopropylmethyl)-N-[1-[(2-methylsulfonylphenyl)methyl]piperidin-4-yl]thiophene-2-sulfonamide Openeye Name: N-(cyclopropylmethyl)-N-[1-[(2-methylsulfonylphenyl)methyl]-4-piperidyl]thiophene-2-sulfonamide CAS Name: N-(cyclopropylmethyl)-N-[1-[(2-methylsulfonylphenyl)methyl]-4-piperidinyl]-2-thiophenesulfonamide IUPAC Name: N-(cyclopropylmethyl)-N-[1-[(2-methylsulfonylphenyl)methyl]piperidin-4-yl]thiophene-2-sulfonamide Traditional Name: N-(cyclopropylmethyl)-N-[1-(2-mesylbenzyl)-4-piperidyl]thiophene-2-sulfonamide Formula: C21H28N2O4S3 MolecularWeight: 468.65302

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1CN2CCC(CC2)N(CC3CC3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1CN2CCC(CC2)N(CC3CC3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H28N2O4S3/c1-29(24,25)20-6-3-2-5-18(20)16-22-12-10-19(11-13-22)23(15-17-8-9-17)30(26,27)21-7-4-14-28-21/h2-7,14,17,19H,8-13,15-16H2,1H3