methyl 2-methyl-2-[(4-methylphenyl)sulfonylamino]-3-sulfanyl-propanoate

Systemtic Name: methyl 2-methyl-2-[(4-methylphenyl)sulfonylamino]-3-sulfanyl-propanoate Openeye Name: methyl 2-methyl-2-(p-tolylsulfonylamino)-3-sulfanyl-propanoate CAS Name: 3-mercapto-2-methyl-2-[(4-methylphenyl)sulfonylamino]propanoic acid methyl ester IUPAC Name: methyl 2-methyl-2-[(4-methylphenyl)sulfonylamino]-3-sulfanylpropanoate Traditional Name: 3-mercapto-2-methyl-2-(tosylamino)propionic acid methyl ester Formula: C12H17NO4S2 MolecularWeight: 303.39768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C)(CS)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C)(CS)C(=O)OC

InChI

InChI=1S/C12H17NO4S2/c1-9-4-6-10(7-5-9)19(15,16)13-12(2,8-18)11(14)17-3/h4-7,13,18H,8H2,1-3H3