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

Systemtic Name: dimethyl 3-methyl-5-(pyrazin-2-ylcarbamothioylamino)thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-methyl-5-(pyrazin-2-ylcarbamothioylamino)thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[(2-pyrazinylamino)-sulfanylidenemethyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-(pyrazin-2-ylcarbamothioylamino)thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-(pyrazin-2-ylthiocarbamoylamino)thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C14H14N4O4S2 MolecularWeight: 366.41536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=S)NC2=NC=CN=C2)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=S)NC2=NC=CN=C2)C(=O)OC

InChI

InChI=1S/C14H14N4O4S2/c1-7-9(12(19)21-2)11(24-10(7)13(20)22-3)18-14(23)17-8-6-15-4-5-16-8/h4-6H,1-3H3,(H2,16,17,18,23)