(5-oxidanylidene-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl 4-tert-butylbenzoate

Systemtic Name: (5-oxidanylidene-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl 4-tert-butylbenzoate Openeye Name: (5-oxothiazolo[3,2-a]pyrimidin-7-yl)methyl 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic 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 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid (5-ketothiazolo[3,2-a]pyrimidin-7-yl)methyl ester Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)OCC2=CC(=O)N3C=CSC3=N2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)OCC2=CC(=O)N3C=CSC3=N2

InChI

InChI=1S/C18H18N2O3S/c1-18(2,3)13-6-4-12(5-7-13)16(22)23-11-14-10-15(21)20-8-9-24-17(20)19-14/h4-10H,11H2,1-3H3