methyl 2-[(3,4-dimethoxyphenyl)sulfonylamino]-3-(phenylmethylsulfanyl)propanoate

Systemtic Name: methyl 2-[(3,4-dimethoxyphenyl)sulfonylamino]-3-(phenylmethylsulfanyl)propanoate Openeye Name: methyl 3-benzylsulfanyl-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanoate CAS Name: 2-[(3,4-dimethoxyphenyl)sulfonylamino]-3-(phenylmethylthio)propanoic acid methyl ester IUPAC Name: methyl 3-benzylsulfanyl-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanoate Traditional Name: 3-(benzylthio)-2-[(3,4-dimethoxyphenyl)sulfonylamino]propionic acid methyl ester Formula: C19H23NO6S2 MolecularWeight: 425.51902

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC(CSCC2=CC=CC=C2)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC(CSCC2=CC=CC=C2)C(=O)OC)OC

InChI

InChI=1S/C19H23NO6S2/c1-24-17-10-9-15(11-18(17)25-2)28(22,23)20-16(19(21)26-3)13-27-12-14-7-5-4-6-8-14/h4-11,16,20H,12-13H2,1-3H3