methyl 3-[(3,4-dimethoxyphenyl)carbamothioylamino]propanoate

Systemtic Name: methyl 3-[(3,4-dimethoxyphenyl)carbamothioylamino]propanoate Openeye Name: methyl 3-[(3,4-dimethoxyphenyl)carbamothioylamino]propanoate CAS Name: 3-[[(3,4-dimethoxyanilino)-sulfanylidenemethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-[(3,4-dimethoxyphenyl)carbamothioylamino]propanoate Traditional Name: 3-[(3,4-dimethoxyphenyl)thiocarbamoylamino]propionic acid methyl ester Formula: C13H18N2O4S MolecularWeight: 298.35802

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=S)NCCC(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=S)NCCC(=O)OC)OC

InChI

InChI=1S/C13H18N2O4S/c1-17-10-5-4-9(8-11(10)18-2)15-13(20)14-7-6-12(16)19-3/h4-5,8H,6-7H2,1-3H3,(H2,14,15,20)