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

Systemtic Name: methyl 4-[(2,3-dimethylphenyl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl 4-(2,3-dimethylanilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-(2,3-dimethylanilino)-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 4-(2,3-dimethylanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-(2,3-dimethylanilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC2=C3C(=C(SC3=NC=N2)C(=O)OC)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC2=C3C(=C(SC3=NC=N2)C(=O)OC)C)C

InChI

InChI=1S/C17H17N3O2S/c1-9-6-5-7-12(10(9)2)20-15-13-11(3)14(17(21)22-4)23-16(13)19-8-18-15/h5-8H,1-4H3,(H,18,19,20)