(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl (E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoate

Systemtic Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl (E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoate Openeye Name: [2-(3-thienyl)thiazol-4-yl]methyl (E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoate CAS Name: (E)-3-[4-(cyanomethoxy)-3-methoxyphenyl]-2-propenoic acid [2-(3-thiophenyl)-4-thiazolyl]methyl ester IUPAC Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl (E)-3-[4-(cyanomethoxy)-3-methoxyphenyl]prop-2-enoate Traditional Name: (E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]acrylic acid [2-(3-thienyl)thiazol-4-yl]methyl ester Formula: C20H16N2O4S2 MolecularWeight: 412.48204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)OCC2=CSC(=N2)C3=CSC=C3)OCC#N

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)OCC2=CSC(=N2)C3=CSC=C3)OCC#N

InChI

InChI=1S/C20H16N2O4S2/c1-24-18-10-14(2-4-17(18)25-8-7-21)3-5-19(23)26-11-16-13-28-20(22-16)15-6-9-27-12-15/h2-6,9-10,12-13H,8,11H2,1H3/b5-3+