(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoate

Systemtic Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoate Openeye Name: [5-(2-thienyl)isoxazol-3-yl]methyl 2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetate CAS Name: 2-(4-thieno[2,3-d]pyrimidinylthio)acetic acid (5-thiophen-2-yl-3-isoxazolyl)methyl ester IUPAC Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetate Traditional Name: 2-(thieno[2,3-d]pyrimidin-4-ylthio)acetic acid [5-(2-thienyl)isoxazol-3-yl]methyl ester Formula: C16H11N3O3S3 MolecularWeight: 389.47184

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=CC(=NO2)COC(=O)CSC3=NC=NC4=C3C=CS4

Isomeric SMILES

C1=CSC(=C1)C2=CC(=NO2)COC(=O)CSC3=NC=NC4=C3C=CS4

InChI

InChI=1S/C16H11N3O3S3/c20-14(8-25-16-11-3-5-24-15(11)17-9-18-16)21-7-10-6-12(22-19-10)13-2-1-4-23-13/h1-6,9H,7-8H2