[2-(butylamino)-2-oxidanylidene-ethyl] 2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoate

Systemtic Name: [2-(butylamino)-2-oxidanylidene-ethyl] 2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoate Openeye Name: [2-(butylamino)-2-oxo-ethyl] 2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetate CAS Name: 2-(4-thieno[2,3-d]pyrimidinylthio)acetic acid [2-(butylamino)-2-oxoethyl] ester IUPAC Name: [2-(butylamino)-2-oxoethyl] 2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetate Traditional Name: 2-(thieno[2,3-d]pyrimidin-4-ylthio)acetic acid [2-(butylamino)-2-keto-ethyl] ester Formula: C14H17N3O3S2 MolecularWeight: 339.43308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)COC(=O)CSC1=NC=NC2=C1C=CS2

Isomeric SMILES

CCCCNC(=O)COC(=O)CSC1=NC=NC2=C1C=CS2

InChI

InChI=1S/C14H17N3O3S2/c1-2-3-5-15-11(18)7-20-12(19)8-22-14-10-4-6-21-13(10)16-9-17-14/h4,6,9H,2-3,5,7-8H2,1H3,(H,15,18)