(4-cyanophenyl)methyl 3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanoate

Systemtic Name: (4-cyanophenyl)methyl 3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanoate Openeye Name: (4-cyanophenyl)methyl 3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanoate CAS Name: 3-(4-oxo-3-thieno[2,3-d]pyrimidinyl)propanoic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanoate Traditional Name: 3-(4-ketothieno[2,3-d]pyrimidin-3-yl)propionic acid (4-cyanobenzyl) ester Formula: C17H13N3O3S MolecularWeight: 339.36842

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC(=O)CCN2C=NC3=C(C2=O)C=CS3)C#N

Isomeric SMILES

C1=CC(=CC=C1COC(=O)CCN2C=NC3=C(C2=O)C=CS3)C#N

InChI

InChI=1S/C17H13N3O3S/c18-9-12-1-3-13(4-2-12)10-23-15(21)5-7-20-11-19-16-14(17(20)22)6-8-24-16/h1-4,6,8,11H,5,7,10H2