N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)-2-[(2-methylsulfanylphenyl)amino]ethanamide

Systemtic Name: N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)-2-[(2-methylsulfanylphenyl)amino]ethanamide Openeye Name: N-[2-methyl-5-(1-piperidylsulfonyl)phenyl]-2-(2-methylsulfanylanilino)acetamide CAS Name: N-[2-methyl-5-(1-piperidinylsulfonyl)phenyl]-2-[2-(methylthio)anilino]acetamide IUPAC Name: N-(2-methyl-5-piperidin-1-ylsulfonylphenyl)-2-(2-methylsulfanylanilino)acetamide Traditional Name: N-(2-methyl-5-piperidinosulfonyl-phenyl)-2-[2-(methylthio)anilino]acetamide Formula: C21H27N3O3S2 MolecularWeight: 433.58738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CNC3=CC=CC=C3SC

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CNC3=CC=CC=C3SC

InChI

InChI=1S/C21H27N3O3S2/c1-16-10-11-17(29(26,27)24-12-6-3-7-13-24)14-19(16)23-21(25)15-22-18-8-4-5-9-20(18)28-2/h4-5,8-11,14,22H,3,6-7,12-13,15H2,1-2H3,(H,23,25)