(3-methyl-5-oxidanylidene-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl 3-ethoxy-4-propoxy-benzoate

Systemtic Name: (3-methyl-5-oxidanylidene-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl 3-ethoxy-4-propoxy-benzoate Openeye Name: (3-methyl-5-oxo-thiazolo[3,2-a]pyrimidin-7-yl)methyl 3-ethoxy-4-propoxy-benzoate CAS Name: 3-ethoxy-4-propoxybenzoic acid (3-methyl-5-oxo-7-thiazolo[3,2-a]pyrimidinyl)methyl ester IUPAC Name: (3-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl 3-ethoxy-4-propoxybenzoate Traditional Name: 3-ethoxy-4-propoxy-benzoic acid (5-keto-3-methyl-thiazolo[3,2-a]pyrimidin-7-yl)methyl ester Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)OCC2=CC(=O)N3C(=CSC3=N2)C)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)OCC2=CC(=O)N3C(=CSC3=N2)C)OCC

InChI

InChI=1S/C20H22N2O5S/c1-4-8-26-16-7-6-14(9-17(16)25-5-2)19(24)27-11-15-10-18(23)22-13(3)12-28-20(22)21-15/h6-7,9-10,12H,4-5,8,11H2,1-3H3