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

Systemtic Name: methyl 2-(1,3-benzodioxol-5-ylcarbonylamino)-4-pyridin-3-yl-thiophene-3-carboxylate Openeye Name: methyl 2-(1,3-benzodioxole-5-carbonylamino)-4-(3-pyridyl)thiophene-3-carboxylate CAS Name: 2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-4-(3-pyridinyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(1,3-benzodioxole-5-carbonylamino)-4-pyridin-3-ylthiophene-3-carboxylate Traditional Name: 2-(piperonyloylamino)-4-(3-pyridyl)thiophene-3-carboxylic acid methyl ester Formula: C19H14N2O5S MolecularWeight: 382.38986

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1C2=CN=CC=C2)NC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC(=O)C1=C(SC=C1C2=CN=CC=C2)NC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H14N2O5S/c1-24-19(23)16-13(12-3-2-6-20-8-12)9-27-18(16)21-17(22)11-4-5-14-15(7-11)26-10-25-14/h2-9H,10H2,1H3,(H,21,22)