4-[(2-ethoxyphenyl)amino]-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 4-[(2-ethoxyphenyl)amino]-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 4-(2-ethoxyanilino)-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-(2-ethoxyanilino)-2,5-dimethyl-6-thieno[2,3-d]pyrimidinecarboxylate IUPAC Name: 4-(2-ethoxyanilino)-2,5-dimethylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2,5-dimethyl-4-(o-phenetidino)thieno[2,3-d]pyrimidine-6-carboxylate Formula: C17H16N3O3S- MolecularWeight: 342.39224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC2=C3C(=C(SC3=NC(=N2)C)C(=O)[O-])C

Isomeric SMILES

CCOC1=CC=CC=C1NC2=C3C(=C(SC3=NC(=N2)C)C(=O)[O-])C

InChI

InChI=1S/C17H17N3O3S/c1-4-23-12-8-6-5-7-11(12)20-15-13-9(2)14(17(21)22)24-16(13)19-10(3)18-15/h5-8H,4H2,1-3H3,(H,21,22)(H,18,19,20)/p-1