dimethyl 2-(prop-2-enylcarbamothioylamino)benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-(prop-2-enylcarbamothioylamino)benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-(allylcarbamothioylamino)benzene-1,4-dicarboxylate CAS Name: 2-[[(prop-2-enylamino)-sulfanylidenemethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-(prop-2-enylcarbamothioylamino)benzene-1,4-dicarboxylate Traditional Name: 2-(allylthiocarbamoylamino)benzene-1,4-dicarboxylic acid dimethyl ester Formula: C14H16N2O4S MolecularWeight: 308.35284

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=S)NCC=C

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=S)NCC=C

InChI

InChI=1S/C14H16N2O4S/c1-4-7-15-14(21)16-11-8-9(12(17)19-2)5-6-10(11)13(18)20-3/h4-6,8H,1,7H2,2-3H3,(H2,15,16,21)