methyl 2-[(3-azanyl-6-phenyl-thieno[2,3-b]pyridin-2-yl)carbonylamino]benzoate

Systemtic Name: methyl 2-[(3-azanyl-6-phenyl-thieno[2,3-b]pyridin-2-yl)carbonylamino]benzoate Openeye Name: methyl 2-[(3-amino-6-phenyl-thieno[2,3-b]pyridine-2-carbonyl)amino]benzoate CAS Name: 2-[[(3-amino-6-phenyl-2-thieno[2,3-b]pyridinyl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[(3-amino-6-phenylthieno[2,3-b]pyridine-2-carbonyl)amino]benzoate Traditional Name: 2-[(3-amino-6-phenyl-thieno[2,3-b]pyridine-2-carbonyl)amino]benzoic acid methyl ester Formula: C22H17N3O3S MolecularWeight: 403.45368

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)C2=C(C3=C(S2)N=C(C=C3)C4=CC=CC=C4)N

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)C2=C(C3=C(S2)N=C(C=C3)C4=CC=CC=C4)N

InChI

InChI=1S/C22H17N3O3S/c1-28-22(27)14-9-5-6-10-17(14)24-20(26)19-18(23)15-11-12-16(25-21(15)29-19)13-7-3-2-4-8-13/h2-12H,23H2,1H3,(H,24,26)