diethyl 2-[(ethoxycarbonylamino)carbamothioylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3,6-dicarboxylate

Systemtic Name: diethyl 2-[(ethoxycarbonylamino)carbamothioylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3,6-dicarboxylate Openeye Name: diethyl 2-[(ethoxycarbonylamino)carbamothioylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3,6-dicarboxylate CAS Name: 2-[[(ethoxycarbonylhydrazo)-sulfanylidenemethyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3,6-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-[(ethoxycarbonylamino)carbamothioylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3,6-dicarboxylate Traditional Name: 2-[(carbethoxyamino)thiocarbamoylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3,6-dicarboxylic acid diethyl ester Formula: C17H24N4O6S2 MolecularWeight: 444.52566

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCN(C2)C(=O)OCC)NC(=S)NNC(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCN(C2)C(=O)OCC)NC(=S)NNC(=O)OCC

InChI

InChI=1S/C17H24N4O6S2/c1-4-25-14(22)12-10-7-8-21(17(24)27-6-3)9-11(10)29-13(12)18-15(28)19-20-16(23)26-5-2/h4-9H2,1-3H3,(H,20,23)(H2,18,19,28)