2-methylpropyl 5-methyl-4-oxidanylidene-2-pyridin-4-yl-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 2-methylpropyl 5-methyl-4-oxidanylidene-2-pyridin-4-yl-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: isobutyl 5-methyl-4-oxo-2-(4-pyridyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-2-pyridin-4-yl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 5-methyl-4-oxo-2-pyridin-4-yl-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-2-(4-pyridyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid isobutyl ester Formula: C17H17N3O3S MolecularWeight: 343.40018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)C3=CC=NC=C3)C(=O)OCC(C)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)C3=CC=NC=C3)C(=O)OCC(C)C

InChI

InChI=1S/C17H17N3O3S/c1-9(2)8-23-17(22)13-10(3)12-15(21)19-14(20-16(12)24-13)11-4-6-18-7-5-11/h4-7,9H,8H2,1-3H3,(H,19,20,21)