dimethyl 5-azanyl-3-[(5-oxidanylidene-4-propyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-azanyl-3-[(5-oxidanylidene-4-propyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)thio]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[[(5-keto-4-propyl-1H-1,2,4-triazol-3-yl)thio]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C14H18N4O5S2 MolecularWeight: 386.44652

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCC2=C(SC(=C2C(=O)OC)N)C(=O)OC

Isomeric SMILES

CCCN1C(=O)NN=C1SCC2=C(SC(=C2C(=O)OC)N)C(=O)OC

InChI

InChI=1S/C14H18N4O5S2/c1-4-5-18-13(21)16-17-14(18)24-6-7-8(11(19)22-2)10(15)25-9(7)12(20)23-3/h4-6,15H2,1-3H3,(H,16,21)