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

Systemtic Name: ethyl 5-(butylcarbamothioylamino)-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-(butylcarbamothioylamino)-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[butylamino(sulfanylidene)methyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(butylcarbamothioylamino)-3-methylthiophene-2-carboxylate Traditional Name: 5-(butylthiocarbamoylamino)-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C13H20N2O2S2 MolecularWeight: 300.4401

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NC1=CC(=C(S1)C(=O)OCC)C

Isomeric SMILES

CCCCNC(=S)NC1=CC(=C(S1)C(=O)OCC)C

InChI

InChI=1S/C13H20N2O2S2/c1-4-6-7-14-13(18)15-10-8-9(3)11(19-10)12(16)17-5-2/h8H,4-7H2,1-3H3,(H2,14,15,18)