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

Systemtic Name: (4-cyanophenyl) 5-methyl-4-oxidanylidene-3-propyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: (4-cyanophenyl) 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-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 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 (4-cyanophenyl) ester Formula: C18H15N3O3S MolecularWeight: 353.395

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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#N)C

Isomeric SMILES

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

InChI

InChI=1S/C18H15N3O3S/c1-3-8-21-10-20-16-14(17(21)22)11(2)15(25-16)18(23)24-13-6-4-12(9-19)5-7-13/h4-7,10H,3,8H2,1-2H3