methyl 2-[(2-ethoxy-2-oxidanylidene-ethyl)carbamothioylamino]-5-ethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(2-ethoxy-2-oxidanylidene-ethyl)carbamothioylamino]-5-ethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(2-ethoxy-2-oxo-ethyl)carbamothioylamino]-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[[(2-ethoxy-2-oxoethyl)amino]-sulfanylidenemethyl]amino]-5-ethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2-ethoxy-2-oxoethyl)carbamothioylamino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[(2-ethoxy-2-keto-ethyl)thiocarbamoylamino]-5-ethyl-thiophene-3-carboxylic acid methyl ester Formula: C13H18N2O4S2 MolecularWeight: 330.42302

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=S)NCC(=O)OCC)C(=O)OC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=S)NCC(=O)OCC)C(=O)OC

InChI

InChI=1S/C13H18N2O4S2/c1-4-8-6-9(12(17)18-3)11(21-8)15-13(20)14-7-10(16)19-5-2/h6H,4-5,7H2,1-3H3,(H2,14,15,20)