phenyl 5-methyl-4-oxidanylidene-3-propyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: phenyl 5-methyl-4-oxidanylidene-3-propyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: phenyl 5-methyl-4-oxo-3-propyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-3-propyl-6-thieno[2,3-d]pyrimidinecarboxylic acid phenyl ester IUPAC Name: phenyl 5-methyl-4-oxo-3-propylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-3-propyl-thieno[2,3-d]pyrimidine-6-carboxylic acid phenyl ester Formula: C17H16N2O3S MolecularWeight: 328.38554

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)OC3=CC=CC=C3)C

Isomeric SMILES

CCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)OC3=CC=CC=C3)C

InChI

InChI=1S/C17H16N2O3S/c1-3-9-19-10-18-15-13(16(19)20)11(2)14(23-15)17(21)22-12-7-5-4-6-8-12/h4-8,10H,3,9H2,1-2H3