ethyl 5-ethanoyl-4-methyl-2-(prop-2-enylcarbamothioylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethanoyl-4-methyl-2-(prop-2-enylcarbamothioylamino)thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-2-(allylcarbamothioylamino)-4-methyl-thiophene-3-carboxylate CAS Name: 5-acetyl-4-methyl-2-[[(prop-2-enylamino)-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-4-methyl-2-(prop-2-enylcarbamothioylamino)thiophene-3-carboxylate Traditional Name: 5-acetyl-2-(allylthiocarbamoylamino)-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C14H18N2O3S2 MolecularWeight: 326.43432

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=S)NCC=C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=S)NCC=C

InChI

InChI=1S/C14H18N2O3S2/c1-5-7-15-14(20)16-12-10(13(18)19-6-2)8(3)11(21-12)9(4)17/h5H,1,6-7H2,2-4H3,(H2,15,16,20)