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

Systemtic Name: ethyl 3-[(3-cyanophenyl)methyl]-6-methyl-4-oxidanylidene-furo[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 3-[(3-cyanophenyl)methyl]-6-methyl-4-oxo-furo[2,3-d]pyrimidine-5-carboxylate CAS Name: 3-[(3-cyanophenyl)methyl]-6-methyl-4-oxo-5-furo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(3-cyanophenyl)methyl]-6-methyl-4-oxofuro[2,3-d]pyrimidine-5-carboxylate Traditional Name: 3-(3-cyanobenzyl)-4-keto-6-methyl-furo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C18H15N3O4 MolecularWeight: 337.3294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C(=O)N(C=N2)CC3=CC=CC(=C3)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C(=O)N(C=N2)CC3=CC=CC(=C3)C#N)C

InChI

InChI=1S/C18H15N3O4/c1-3-24-18(23)14-11(2)25-16-15(14)17(22)21(10-20-16)9-13-6-4-5-12(7-13)8-19/h4-7,10H,3,9H2,1-2H3