ethyl 3-methyl-5-(3-methylsulfanylpropylcarbamothioylamino)thiophene-2-carboxylate

Systemtic Name: ethyl 3-methyl-5-(3-methylsulfanylpropylcarbamothioylamino)thiophene-2-carboxylate Openeye Name: ethyl 3-methyl-5-(3-methylsulfanylpropylcarbamothioylamino)thiophene-2-carboxylate CAS Name: 3-methyl-5-[[[3-(methylthio)propylamino]-sulfanylidenemethyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-5-(3-methylsulfanylpropylcarbamothioylamino)thiophene-2-carboxylate Traditional Name: 3-methyl-5-[3-(methylthio)propylthiocarbamoylamino]thiophene-2-carboxylic acid ethyl ester Formula: C13H20N2O2S3 MolecularWeight: 332.5051

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=S)NCCCSC)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=S)NCCCSC)C

InChI

InChI=1S/C13H20N2O2S3/c1-4-17-12(16)11-9(2)8-10(20-11)15-13(18)14-6-5-7-19-3/h8H,4-7H2,1-3H3,(H2,14,15,18)