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

Systemtic Name: methyl 5-methyl-4-(2-methylpropanoylamino)-2-phenyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl 5-methyl-4-(2-methylpropanoylamino)-2-phenyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-[(2-methyl-1-oxopropyl)amino]-2-phenyl-6-thieno[2,3-d]pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 5-methyl-4-(2-methylpropanoylamino)-2-phenylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-(isobutyrylamino)-5-methyl-2-phenyl-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)NC(=O)C(C)C)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)NC(=O)C(C)C)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C19H19N3O3S/c1-10(2)17(23)21-16-13-11(3)14(19(24)25-4)26-18(13)22-15(20-16)12-8-6-5-7-9-12/h5-10H,1-4H3,(H,20,21,22,23)