3-[(4-methoxyphenyl)carbamothioylamino]propanoic acid

Systemtic Name: 3-[(4-methoxyphenyl)carbamothioylamino]propanoic acid Openeye Name: 3-[(4-methoxyphenyl)carbamothioylamino]propanoic acid CAS Name: 3-[[(4-methoxyanilino)-sulfanylidenemethyl]amino]propanoic acid IUPAC Name: 3-[(4-methoxyphenyl)carbamothioylamino]propanoic acid Traditional Name: 3-[(4-methoxyphenyl)thiocarbamoylamino]propionic acid Formula: C11H14N2O3S MolecularWeight: 254.30546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N2O3S/c1-16-9-4-2-8(3-5-9)13-11(17)12-7-6-10(14)15/h2-5H,6-7H2,1H3,(H,14,15)(H2,12,13,17)