methyl 3-[(4-methoxyphenyl)carbamothioylamino]propanoate

Systemtic Name: methyl 3-[(4-methoxyphenyl)carbamothioylamino]propanoate Openeye Name: methyl 3-[(4-methoxyphenyl)carbamothioylamino]propanoate CAS Name: 3-[[(4-methoxyanilino)-sulfanylidenemethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-[(4-methoxyphenyl)carbamothioylamino]propanoate Traditional Name: 3-[(4-methoxyphenyl)thiocarbamoylamino]propionic acid methyl ester Formula: C12H16N2O3S MolecularWeight: 268.33204

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O3S/c1-16-10-5-3-9(4-6-10)14-12(18)13-8-7-11(15)17-2/h3-6H,7-8H2,1-2H3,(H2,13,14,18)