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

Systemtic Name: (phenylmethyl) 3-azanyl-6-(2-methoxyphenyl)-4-phenyl-thieno[2,3-b]pyridine-2-carboxylate Openeye Name: benzyl 3-amino-6-(2-methoxyphenyl)-4-phenyl-thieno[2,3-b]pyridine-2-carboxylate CAS Name: 3-amino-6-(2-methoxyphenyl)-4-phenyl-2-thieno[2,3-b]pyridinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-amino-6-(2-methoxyphenyl)-4-phenylthieno[2,3-b]pyridine-2-carboxylate Traditional Name: 3-amino-6-(2-methoxyphenyl)-4-phenyl-thieno[2,3-b]pyridine-2-carboxylic acid benzyl ester Formula: C28H22N2O3S MolecularWeight: 466.55088

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NC3=C(C(=C2)C4=CC=CC=C4)C(=C(S3)C(=O)OCC5=CC=CC=C5)N

Isomeric SMILES

COC1=CC=CC=C1C2=NC3=C(C(=C2)C4=CC=CC=C4)C(=C(S3)C(=O)OCC5=CC=CC=C5)N

InChI

InChI=1S/C28H22N2O3S/c1-32-23-15-9-8-14-20(23)22-16-21(19-12-6-3-7-13-19)24-25(29)26(34-27(24)30-22)28(31)33-17-18-10-4-2-5-11-18/h2-16H,17,29H2,1H3