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

Systemtic Name: (4-methylphenyl) 5-methyl-4-oxidanylidene-3-propyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: p-tolyl 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 (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) 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 p-tolyl ester Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O3S/c1-4-9-20-10-19-16-14(17(20)21)12(3)15(24-16)18(22)23-13-7-5-11(2)6-8-13/h5-8,10H,4,9H2,1-3H3