methyl 2-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]propanoate

Systemtic Name: methyl 2-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]propanoate Openeye Name: methyl 2-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]propanoate CAS Name: 2-[[[[(E)-1-oxo-3-phenylprop-2-enyl]amino]-sulfanylidenemethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 2-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]propanoate Traditional Name: 2-[[(E)-3-phenylacryloyl]thiocarbamoylamino]propionic acid methyl ester Formula: C14H16N2O3S MolecularWeight: 292.35344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C(=O)OC)NC(=S)NC(=O)/C=C/C1=CC=CC=C1

InChI

InChI=1S/C14H16N2O3S/c1-10(13(18)19-2)15-14(20)16-12(17)9-8-11-6-4-3-5-7-11/h3-10H,1-2H3,(H2,15,16,17,20)/b9-8+