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

Systemtic Name: ethyl 5-(1,3-benzodioxol-5-yl)-3-(pyridin-2-ylcarbonylamino)thiophene-2-carboxylate Openeye Name: ethyl 5-(1,3-benzodioxol-5-yl)-3-(pyridine-2-carbonylamino)thiophene-2-carboxylate CAS Name: 5-(1,3-benzodioxol-5-yl)-3-[[oxo(2-pyridinyl)methyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(1,3-benzodioxol-5-yl)-3-(pyridine-2-carbonylamino)thiophene-2-carboxylate Traditional Name: 5-(1,3-benzodioxol-5-yl)-3-picolinamido-thiophene-2-carboxylic acid ethyl ester Formula: C20H16N2O5S MolecularWeight: 396.41644

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC3=C(C=C2)OCO3)NC(=O)C4=CC=CC=N4

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC3=C(C=C2)OCO3)NC(=O)C4=CC=CC=N4

InChI

InChI=1S/C20H16N2O5S/c1-2-25-20(24)18-14(22-19(23)13-5-3-4-8-21-13)10-17(28-18)12-6-7-15-16(9-12)27-11-26-15/h3-10H,2,11H2,1H3,(H,22,23)