1,3-benzoxazol-2-ylmethyl 2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoate

Systemtic Name: 1,3-benzoxazol-2-ylmethyl 2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoate Openeye Name: 1,3-benzoxazol-2-ylmethyl 2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetate CAS Name: 2-(4-thieno[2,3-d]pyrimidinylthio)acetic acid 1,3-benzoxazol-2-ylmethyl ester IUPAC Name: 1,3-benzoxazol-2-ylmethyl 2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetate Traditional Name: 2-(thieno[2,3-d]pyrimidin-4-ylthio)acetic acid 1,3-benzoxazol-2-ylmethyl ester Formula: C16H11N3O3S2 MolecularWeight: 357.40684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)COC(=O)CSC3=NC=NC4=C3C=CS4

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)COC(=O)CSC3=NC=NC4=C3C=CS4

InChI

InChI=1S/C16H11N3O3S2/c20-14(8-24-16-10-5-6-23-15(10)17-9-18-16)21-7-13-19-11-3-1-2-4-12(11)22-13/h1-6,9H,7-8H2