1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-sulfonyl-urea; methyl thiophene-2-carboxylate

Systemtic Name: 1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-sulfonyl-urea; methyl thiophene-2-carboxylate Openeye Name: 1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-sulfonyl-urea; methyl thiophene-2-carboxylate CAS Name: 1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-sulfonylurea; 2-thiophenecarboxylic acid methyl ester IUPAC Name: 1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-sulfonylurea; methyl thiophene-2-carboxylate Traditional Name: 1-(4-methoxy-6-methyl-s-triazin-2-yl)-3-sulfonyl-urea; thiophene-2-carboxylic acid methyl ester Formula: C12H13N5O6S2 MolecularWeight: 387.39152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=N1)OC)NC(=O)N=S(=O)=O.COC(=O)C1=CC=CS1

Isomeric SMILES

CC1=NC(=NC(=N1)OC)NC(=O)N=S(=O)=O.COC(=O)C1=CC=CS1

InChI

InChI=1S/C6H7N5O4S.C6H6O2S/c1-3-7-4(10-6(8-3)15-2)9-5(12)11-16(13)14;1-8-6(7)5-3-2-4-9-5/h1-2H3,(H,7,8,9,10,12);2-4H,1H3