4-methyl-5-phenylmethoxycarbonyl-2-(pyridin-3-ylcarbonylamino)thiophene-3-carboxylate

Systemtic Name: 4-methyl-5-phenylmethoxycarbonyl-2-(pyridin-3-ylcarbonylamino)thiophene-3-carboxylate Openeye Name: 5-benzyloxycarbonyl-4-methyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate CAS Name: 4-methyl-2-[[oxo(3-pyridinyl)methyl]amino]-5-phenylmethoxycarbonyl-3-thiophenecarboxylate IUPAC Name: 4-methyl-5-phenylmethoxycarbonyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate Traditional Name: 5-carbobenzoxy-4-methyl-2-nicotinamido-3-thenoate Formula: C20H15N2O5S- MolecularWeight: 395.4085

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)[O-])NC(=O)C2=CN=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=C(SC(=C1C(=O)[O-])NC(=O)C2=CN=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H16N2O5S/c1-12-15(19(24)25)18(22-17(23)14-8-5-9-21-10-14)28-16(12)20(26)27-11-13-6-3-2-4-7-13/h2-10H,11H2,1H3,(H,22,23)(H,24,25)/p-1