[2-[(3-ethylphenyl)amino]-2-oxidanylidene-ethyl] 3-azanyl-4,6-dimethyl-thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: [2-[(3-ethylphenyl)amino]-2-oxidanylidene-ethyl] 3-azanyl-4,6-dimethyl-thieno[2,3-b]pyridine-2-carboxylate Openeye Name: [2-(3-ethylanilino)-2-oxo-ethyl] 3-amino-4,6-dimethyl-thieno[2,3-b]pyridine-2-carboxylate CAS Name: 3-amino-4,6-dimethyl-2-thieno[2,3-b]pyridinecarboxylic acid [2-(3-ethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-ethylanilino)-2-oxoethyl] 3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carboxylate Traditional Name: 3-amino-4,6-dimethyl-thieno[2,3-b]pyridine-2-carboxylic acid [2-(3-ethylanilino)-2-keto-ethyl] ester Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)COC(=O)C2=C(C3=C(S2)N=C(C=C3C)C)N

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)COC(=O)C2=C(C3=C(S2)N=C(C=C3C)C)N

InChI

InChI=1S/C20H21N3O3S/c1-4-13-6-5-7-14(9-13)23-15(24)10-26-20(25)18-17(21)16-11(2)8-12(3)22-19(16)27-18/h5-9H,4,10,21H2,1-3H3,(H,23,24)