ethyl 3-azanyl-4-(3,4-dimethoxyphenyl)-6-methyl-5-(phenylcarbamoyl)thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: ethyl 3-azanyl-4-(3,4-dimethoxyphenyl)-6-methyl-5-(phenylcarbamoyl)thieno[2,3-b]pyridine-2-carboxylate Openeye Name: ethyl 3-amino-4-(3,4-dimethoxyphenyl)-6-methyl-5-(phenylcarbamoyl)thieno[2,3-b]pyridine-2-carboxylate CAS Name: 3-amino-5-[anilino(oxo)methyl]-4-(3,4-dimethoxyphenyl)-6-methyl-2-thieno[2,3-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-amino-4-(3,4-dimethoxyphenyl)-6-methyl-5-(phenylcarbamoyl)thieno[2,3-b]pyridine-2-carboxylate Traditional Name: 3-amino-4-(3,4-dimethoxyphenyl)-6-methyl-5-(phenylcarbamoyl)thieno[2,3-b]pyridine-2-carboxylic acid ethyl ester Formula: C26H25N3O5S MolecularWeight: 491.5588

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C(=C(N=C2S1)C)C(=O)NC3=CC=CC=C3)C4=CC(=C(C=C4)OC)OC)N

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C(=C(N=C2S1)C)C(=O)NC3=CC=CC=C3)C4=CC(=C(C=C4)OC)OC)N

InChI

InChI=1S/C26H25N3O5S/c1-5-34-26(31)23-22(27)21-20(15-11-12-17(32-3)18(13-15)33-4)19(14(2)28-25(21)35-23)24(30)29-16-9-7-6-8-10-16/h6-13H,5,27H2,1-4H3,(H,29,30)