(3-methylphenyl) 3-azanyl-6-pyridin-3-yl-thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: (3-methylphenyl) 3-azanyl-6-pyridin-3-yl-thieno[2,3-b]pyridine-2-carboxylate Openeye Name: m-tolyl 3-amino-6-(3-pyridyl)thieno[2,3-b]pyridine-2-carboxylate CAS Name: 3-amino-6-(3-pyridinyl)-2-thieno[2,3-b]pyridinecarboxylic acid (3-methylphenyl) ester IUPAC Name: (3-methylphenyl) 3-amino-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxylate Traditional Name: 3-amino-6-(3-pyridyl)thieno[2,3-b]pyridine-2-carboxylic acid m-tolyl ester Formula: C20H15N3O2S MolecularWeight: 361.417

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC(=O)C2=C(C3=C(S2)N=C(C=C3)C4=CN=CC=C4)N

Isomeric SMILES

CC1=CC(=CC=C1)OC(=O)C2=C(C3=C(S2)N=C(C=C3)C4=CN=CC=C4)N

InChI

InChI=1S/C20H15N3O2S/c1-12-4-2-6-14(10-12)25-20(24)18-17(21)15-7-8-16(23-19(15)26-18)13-5-3-9-22-11-13/h2-11H,21H2,1H3