2-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-(4-piperidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-(4-piperidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-(2,5-dimethyl-N-methylsulfonyl-anilino)-N-[4-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-(2,5-dimethyl-N-methylsulfonylanilino)-N-[4-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(2,5-dimethyl-N-methylsulfonylanilino)-N-(4-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(N-mesyl-2,5-dimethyl-anilino)-N-(4-piperidinosulfonylphenyl)acetamide Formula: C22H29N3O5S2 MolecularWeight: 479.61276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N(CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)N(CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)S(=O)(=O)C

InChI

InChI=1S/C22H29N3O5S2/c1-17-7-8-18(2)21(15-17)25(31(3,27)28)16-22(26)23-19-9-11-20(12-10-19)32(29,30)24-13-5-4-6-14-24/h7-12,15H,4-6,13-14,16H2,1-3H3,(H,23,26)