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

Systemtic Name: (4-methylphenyl)methyl 3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanoate Openeye Name: p-tolylmethyl 3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanoate CAS Name: 3-(4-oxo-3-thieno[2,3-d]pyrimidinyl)propanoic acid (4-methylphenyl)methyl ester IUPAC Name: (4-methylphenyl)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-methylbenzyl) ester Formula: C17H16N2O3S MolecularWeight: 328.38554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC(=O)CCN2C=NC3=C(C2=O)C=CS3

Isomeric SMILES

CC1=CC=C(C=C1)COC(=O)CCN2C=NC3=C(C2=O)C=CS3

InChI

InChI=1S/C17H16N2O3S/c1-12-2-4-13(5-3-12)10-22-15(20)6-8-19-11-18-16-14(17(19)21)7-9-23-16/h2-5,7,9,11H,6,8,10H2,1H3