dimethyl 3-methyl-5-(propylcarbamothioylamino)thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-methyl-5-(propylcarbamothioylamino)thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-methyl-5-(propylcarbamothioylamino)thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[propylamino(sulfanylidene)methyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-(propylcarbamothioylamino)thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-(propylthiocarbamoylamino)thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C13H18N2O4S2 MolecularWeight: 330.42302

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=S)NC1=C(C(=C(S1)C(=O)OC)C)C(=O)OC

Isomeric SMILES

CCCNC(=S)NC1=C(C(=C(S1)C(=O)OC)C)C(=O)OC

InChI

InChI=1S/C13H18N2O4S2/c1-5-6-14-13(20)15-10-8(11(16)18-3)7(2)9(21-10)12(17)19-4/h5-6H2,1-4H3,(H2,14,15,20)