(3-methyl-1,2-oxazol-5-yl)methyl 3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanoate

Systemtic Name: (3-methyl-1,2-oxazol-5-yl)methyl 3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanoate Openeye Name: (3-methylisoxazol-5-yl)methyl 3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanoate CAS Name: 3-(4-oxo-3-thieno[2,3-d]pyrimidinyl)propanoic acid (3-methyl-5-isoxazolyl)methyl ester IUPAC Name: (3-methyl-1,2-oxazol-5-yl)methyl 3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanoate Traditional Name: 3-(4-ketothieno[2,3-d]pyrimidin-3-yl)propionic acid (3-methylisoxazol-5-yl)methyl ester Formula: C14H13N3O4S MolecularWeight: 319.33572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13N3O4S/c1-9-6-10(21-16-9)7-20-12(18)2-4-17-8-15-13-11(14(17)19)3-5-22-13/h3,5-6,8H,2,4,7H2,1H3