ethyl 4-(butylamino)-2-(2-methoxy-2-oxidanylidene-ethyl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 4-(butylamino)-2-(2-methoxy-2-oxidanylidene-ethyl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-(butylamino)-2-(2-methoxy-2-oxo-ethyl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-(butylamino)-2-(2-methoxy-2-oxoethyl)-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(butylamino)-2-(2-methoxy-2-oxoethyl)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-(butylamino)-2-(2-keto-2-methoxy-ethyl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C17H23N3O4S MolecularWeight: 365.44722

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C2C(=C(SC2=NC(=N1)CC(=O)OC)C(=O)OCC)C

Isomeric SMILES

CCCCNC1=C2C(=C(SC2=NC(=N1)CC(=O)OC)C(=O)OCC)C

InChI

InChI=1S/C17H23N3O4S/c1-5-7-8-18-15-13-10(3)14(17(22)24-6-2)25-16(13)20-11(19-15)9-12(21)23-4/h5-9H2,1-4H3,(H,18,19,20)