2-[(2-methylphenyl)-methylsulfonyl-amino]-N-[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]ethanamide

Systemtic Name: 2-[(2-methylphenyl)-methylsulfonyl-amino]-N-[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]ethanamide Openeye Name: 2-(2-methyl-N-methylsulfonyl-anilino)-N-[4-[[(3S)-3-methyl-1-piperidyl]sulfonyl]phenyl]acetamide CAS Name: 2-(2-methyl-N-methylsulfonylanilino)-N-[4-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]phenyl]acetamide IUPAC Name: 2-(2-methyl-N-methylsulfonylanilino)-N-[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]acetamide Traditional Name: 2-(N-mesyl-2-methyl-anilino)-N-[4-[(3S)-3-methylpiperidino]sulfonylphenyl]acetamide Formula: C22H29N3O5S2 MolecularWeight: 479.61276

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CN(C3=CC=CC=C3C)S(=O)(=O)C

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CN(C3=CC=CC=C3C)S(=O)(=O)C

InChI

InChI=1S/C22H29N3O5S2/c1-17-7-6-14-24(15-17)32(29,30)20-12-10-19(11-13-20)23-22(26)16-25(31(3,27)28)21-9-5-4-8-18(21)2/h4-5,8-13,17H,6-7,14-16H2,1-3H3,(H,23,26)/t17-/m0/s1