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

Systemtic Name: 3-cyanopropyl 3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanoate Openeye Name: 3-cyanopropyl 3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanoate CAS Name: 3-(4-oxo-3-thieno[2,3-d]pyrimidinyl)propanoic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl 3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanoate Traditional Name: 3-(4-ketothieno[2,3-d]pyrimidin-3-yl)propionic acid 3-cyanopropyl ester Formula: C13H13N3O3S MolecularWeight: 291.32562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC2=C1C(=O)N(C=N2)CCC(=O)OCCCC#N

Isomeric SMILES

C1=CSC2=C1C(=O)N(C=N2)CCC(=O)OCCCC#N

InChI

InChI=1S/C13H13N3O3S/c14-5-1-2-7-19-11(17)3-6-16-9-15-12-10(13(16)18)4-8-20-12/h4,8-9H,1-3,6-7H2