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

Systemtic Name: methyl 2-(1,3-benzodioxol-5-ylcarbonylamino)-4-methyl-5-(propan-2-ylcarbamoyl)thiophene-3-carboxylate Openeye Name: methyl 2-(1,3-benzodioxole-5-carbonylamino)-5-(isopropylcarbamoyl)-4-methyl-thiophene-3-carboxylate CAS Name: 2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-4-methyl-5-[oxo-(propan-2-ylamino)methyl]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(1,3-benzodioxole-5-carbonylamino)-4-methyl-5-(propan-2-ylcarbamoyl)thiophene-3-carboxylate Traditional Name: 5-(isopropylcarbamoyl)-4-methyl-2-(piperonyloylamino)thiophene-3-carboxylic acid methyl ester Formula: C19H20N2O6S MolecularWeight: 404.4369

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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)NC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O6S/c1-9(2)20-17(23)15-10(3)14(19(24)25-4)18(28-15)21-16(22)11-5-6-12-13(7-11)27-8-26-12/h5-7,9H,8H2,1-4H3,(H,20,23)(H,21,22)