2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(1-methylsulfonylpiperidin-4-yl)ethanamide

Systemtic Name: 2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(1-methylsulfonylpiperidin-4-yl)ethanamide Openeye Name: 2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-N-(1-methylsulfonyl-4-piperidyl)acetamide CAS Name: 2-[[2-(4-methylanilino)-2-oxoethyl]thio]-N-(1-methylsulfonyl-4-piperidinyl)acetamide IUPAC Name: 2-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-N-(1-methylsulfonylpiperidin-4-yl)acetamide Traditional Name: 2-[[2-keto-2-(p-toluidino)ethyl]thio]-N-(1-mesyl-4-piperidyl)acetamide Formula: C17H25N3O4S2 MolecularWeight: 399.5281

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSCC(=O)NC2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSCC(=O)NC2CCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C17H25N3O4S2/c1-13-3-5-14(6-4-13)18-16(21)11-25-12-17(22)19-15-7-9-20(10-8-15)26(2,23)24/h3-6,15H,7-12H2,1-2H3,(H,18,21)(H,19,22)