ethyl 4,6-dimethyl-3-[(4-methylphenyl)carbamoylamino]thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: ethyl 4,6-dimethyl-3-[(4-methylphenyl)carbamoylamino]thieno[2,3-b]pyridine-2-carboxylate Openeye Name: ethyl 4,6-dimethyl-3-(p-tolylcarbamoylamino)thieno[2,3-b]pyridine-2-carboxylate CAS Name: 4,6-dimethyl-3-[[(4-methylanilino)-oxomethyl]amino]-2-thieno[2,3-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 4,6-dimethyl-3-[(4-methylphenyl)carbamoylamino]thieno[2,3-b]pyridine-2-carboxylate Traditional Name: 4,6-dimethyl-3-(p-tolylcarbamoylamino)thieno[2,3-b]pyridine-2-carboxylic acid ethyl ester Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(C=C2C)C)NC(=O)NC3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(C=C2C)C)NC(=O)NC3=CC=C(C=C3)C

InChI

InChI=1S/C20H21N3O3S/c1-5-26-19(24)17-16(15-12(3)10-13(4)21-18(15)27-17)23-20(25)22-14-8-6-11(2)7-9-14/h6-10H,5H2,1-4H3,(H2,22,23,25)