(5-oxidanylidene-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl (E)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]prop-2-enoate

Systemtic Name: (5-oxidanylidene-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl (E)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]prop-2-enoate Openeye Name: (5-oxothiazolo[3,2-a]pyrimidin-7-yl)methyl (E)-3-(4-isobutoxy-3-methoxy-phenyl)prop-2-enoate CAS Name: (E)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]-2-propenoic 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 (E)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]prop-2-enoate Traditional Name: (E)-3-(4-isobutoxy-3-methoxy-phenyl)acrylic acid (5-ketothiazolo[3,2-a]pyrimidin-7-yl)methyl ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C=CC(=O)OCC2=CC(=O)N3C=CSC3=N2)OC

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)/C=C/C(=O)OCC2=CC(=O)N3C=CSC3=N2)OC

InChI

InChI=1S/C21H22N2O5S/c1-14(2)12-27-17-6-4-15(10-18(17)26-3)5-7-20(25)28-13-16-11-19(24)23-8-9-29-21(23)22-16/h4-11,14H,12-13H2,1-3H3/b7-5+