methyl 3-methyl-5-(prop-2-enylcarbamothioylamino)thiophene-2-carboxylate

Systemtic Name: methyl 3-methyl-5-(prop-2-enylcarbamothioylamino)thiophene-2-carboxylate Openeye Name: methyl 5-(allylcarbamothioylamino)-3-methyl-thiophene-2-carboxylate CAS Name: 3-methyl-5-[[(prop-2-enylamino)-sulfanylidenemethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-methyl-5-(prop-2-enylcarbamothioylamino)thiophene-2-carboxylate Traditional Name: 5-(allylthiocarbamoylamino)-3-methyl-thiophene-2-carboxylic acid methyl ester Formula: C11H14N2O2S2 MolecularWeight: 270.37106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=S)NCC=C)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1)NC(=S)NCC=C)C(=O)OC

InChI

InChI=1S/C11H14N2O2S2/c1-4-5-12-11(16)13-8-6-7(2)9(17-8)10(14)15-3/h4,6H,1,5H2,2-3H3,(H2,12,13,16)