3-cyanopropyl 2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoate

Systemtic Name: 3-cyanopropyl 2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoate Openeye Name: 3-cyanopropyl 2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetate CAS Name: 2-(4-thieno[2,3-d]pyrimidinylthio)acetic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl 2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetate Traditional Name: 2-(thieno[2,3-d]pyrimidin-4-ylthio)acetic acid 3-cyanopropyl ester Formula: C12H11N3O2S2 MolecularWeight: 293.36464

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC2=C1C(=NC=N2)SCC(=O)OCCCC#N

Isomeric SMILES

C1=CSC2=C1C(=NC=N2)SCC(=O)OCCCC#N

InChI

InChI=1S/C12H11N3O2S2/c13-4-1-2-5-17-10(16)7-19-12-9-3-6-18-11(9)14-8-15-12/h3,6,8H,1-2,5,7H2