methyl 5-(3-morpholin-4-ylpropylcarbamothioylamino)thiophene-2-carboxylate

Systemtic Name: methyl 5-(3-morpholin-4-ylpropylcarbamothioylamino)thiophene-2-carboxylate Openeye Name: methyl 5-(3-morpholinopropylcarbamothioylamino)thiophene-2-carboxylate CAS Name: 5-[[[3-(4-morpholinyl)propylamino]-sulfanylidenemethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(3-morpholin-4-ylpropylcarbamothioylamino)thiophene-2-carboxylate Traditional Name: 5-(3-morpholinopropylthiocarbamoylamino)thiophene-2-carboxylic acid methyl ester Formula: C14H21N3O3S2 MolecularWeight: 343.46484

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(S1)NC(=S)NCCCN2CCOCC2

Isomeric SMILES

COC(=O)C1=CC=C(S1)NC(=S)NCCCN2CCOCC2

InChI

InChI=1S/C14H21N3O3S2/c1-19-13(18)11-3-4-12(22-11)16-14(21)15-5-2-6-17-7-9-20-10-8-17/h3-4H,2,5-10H2,1H3,(H2,15,16,21)