methyl 4-(2-morpholin-4-ylethylcarbamothioylamino)thiophene-3-carboxylate

Systemtic Name: methyl 4-(2-morpholin-4-ylethylcarbamothioylamino)thiophene-3-carboxylate Openeye Name: methyl 4-(2-morpholinoethylcarbamothioylamino)thiophene-3-carboxylate CAS Name: 4-[[[2-(4-morpholinyl)ethylamino]-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(2-morpholin-4-ylethylcarbamothioylamino)thiophene-3-carboxylate Traditional Name: 4-(2-morpholinoethylthiocarbamoylamino)thiophene-3-carboxylic acid methyl ester Formula: C13H19N3O3S2 MolecularWeight: 329.43826

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CSC=C1NC(=S)NCCN2CCOCC2

Isomeric SMILES

COC(=O)C1=CSC=C1NC(=S)NCCN2CCOCC2

InChI

InChI=1S/C13H19N3O3S2/c1-18-12(17)10-8-21-9-11(10)15-13(20)14-2-3-16-4-6-19-7-5-16/h8-9H,2-7H2,1H3,(H2,14,15,20)