methyl 5-aminocarbonyl-2-(1,3-benzodioxol-5-ylcarbonylamino)-4-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 5-aminocarbonyl-2-(1,3-benzodioxol-5-ylcarbonylamino)-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-(1,3-benzodioxole-5-carbonylamino)-5-carbamoyl-4-methyl-thiophene-3-carboxylate CAS Name: 2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-5-carbamoyl-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(1,3-benzodioxole-5-carbonylamino)-5-carbamoyl-4-methylthiophene-3-carboxylate Traditional Name: 5-carbamoyl-4-methyl-2-(piperonyloylamino)thiophene-3-carboxylic acid methyl ester Formula: C16H14N2O6S MolecularWeight: 362.35716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC3=C(C=C2)OCO3)C(=O)N

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC3=C(C=C2)OCO3)C(=O)N

InChI

InChI=1S/C16H14N2O6S/c1-7-11(16(21)22-2)15(25-12(7)13(17)19)18-14(20)8-3-4-9-10(5-8)24-6-23-9/h3-5H,6H2,1-2H3,(H2,17,19)(H,18,20)