2-[(2-methylphenyl)-methylsulfonyl-amino]-N-(3-piperidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[(2-methylphenyl)-methylsulfonyl-amino]-N-(3-piperidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-(2-methyl-N-methylsulfonyl-anilino)-N-[3-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-(2-methyl-N-methylsulfonylanilino)-N-[3-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(2-methyl-N-methylsulfonylanilino)-N-(3-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(N-mesyl-2-methyl-anilino)-N-(3-piperidinosulfonylphenyl)acetamide Formula: C21H27N3O5S2 MolecularWeight: 465.58618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=CC=C1N(CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)S(=O)(=O)C

InChI

InChI=1S/C21H27N3O5S2/c1-17-9-4-5-12-20(17)24(30(2,26)27)16-21(25)22-18-10-8-11-19(15-18)31(28,29)23-13-6-3-7-14-23/h4-5,8-12,15H,3,6-7,13-14,16H2,1-2H3,(H,22,25)