(5-oxidanylidene-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl 2-ethylsulfanylbenzoate

Systemtic Name: (5-oxidanylidene-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl 2-ethylsulfanylbenzoate Openeye Name: (5-oxothiazolo[3,2-a]pyrimidin-7-yl)methyl 2-ethylsulfanylbenzoate CAS Name: 2-(ethylthio)benzoic acid (5-oxo-7-thiazolo[3,2-a]pyrimidinyl)methyl ester IUPAC Name: (5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl 2-ethylsulfanylbenzoate Traditional Name: 2-(ethylthio)benzoic acid (5-ketothiazolo[3,2-a]pyrimidin-7-yl)methyl ester Formula: C16H14N2O3S2 MolecularWeight: 346.42396

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1C(=O)OCC2=CC(=O)N3C=CSC3=N2

Isomeric SMILES

CCSC1=CC=CC=C1C(=O)OCC2=CC(=O)N3C=CSC3=N2

InChI

InChI=1S/C16H14N2O3S2/c1-2-22-13-6-4-3-5-12(13)15(20)21-10-11-9-14(19)18-7-8-23-16(18)17-11/h3-9H,2,10H2,1H3