3-azanyl-6-phenyl-4-(3,4,5-trimethoxyphenyl)thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: 3-azanyl-6-phenyl-4-(3,4,5-trimethoxyphenyl)thieno[2,3-b]pyridine-2-carboxylate Openeye Name: 3-amino-6-phenyl-4-(3,4,5-trimethoxyphenyl)thieno[2,3-b]pyridine-2-carboxylate CAS Name: 3-amino-6-phenyl-4-(3,4,5-trimethoxyphenyl)-2-thieno[2,3-b]pyridinecarboxylate IUPAC Name: 3-amino-6-phenyl-4-(3,4,5-trimethoxyphenyl)thieno[2,3-b]pyridine-2-carboxylate Traditional Name: 3-amino-6-phenyl-4-(3,4,5-trimethoxyphenyl)thieno[2,3-b]pyridine-2-carboxylate Formula: C23H19N2O5S- MolecularWeight: 435.47236

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=CC(=NC3=C2C(=C(S3)C(=O)[O-])N)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=CC(=NC3=C2C(=C(S3)C(=O)[O-])N)C4=CC=CC=C4

InChI

InChI=1S/C23H20N2O5S/c1-28-16-9-13(10-17(29-2)20(16)30-3)14-11-15(12-7-5-4-6-8-12)25-22-18(14)19(24)21(31-22)23(26)27/h4-11H,24H2,1-3H3,(H,26,27)/p-1