methyl 2-(prop-2-enylcarbamothioylamino)benzoate

Systemtic Name: methyl 2-(prop-2-enylcarbamothioylamino)benzoate Openeye Name: methyl 2-(allylcarbamothioylamino)benzoate CAS Name: 2-[[(prop-2-enylamino)-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-(prop-2-enylcarbamothioylamino)benzoate Traditional Name: 2-(allylthiocarbamoylamino)benzoic acid methyl ester Formula: C12H14N2O2S MolecularWeight: 250.31676

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=S)NCC=C

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=S)NCC=C

InChI

InChI=1S/C12H14N2O2S/c1-3-8-13-12(17)14-10-7-5-4-6-9(10)11(15)16-2/h3-7H,1,8H2,2H3,(H2,13,14,17)