[4-[(E)-2-cyano-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]-2-methoxy-phenyl] 4-fluoranylbenzoate

Systemtic Name: [4-[(E)-2-cyano-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]-2-methoxy-phenyl] 4-fluoranylbenzoate Openeye Name: [4-[(E)-2-cyano-2-(4-methylthiazol-2-yl)vinyl]-2-methoxy-phenyl] 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid [4-[(E)-2-cyano-2-(4-methyl-2-thiazolyl)ethenyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-2-cyano-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]-2-methoxyphenyl] 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid [4-[(E)-2-cyano-2-(4-methylthiazol-2-yl)vinyl]-2-methoxy-phenyl] ester Formula: C21H15FN2O3S MolecularWeight: 394.418803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(=CC2=CC(=C(C=C2)OC(=O)C3=CC=C(C=C3)F)OC)C#N

Isomeric SMILES

CC1=CSC(=N1)/C(=C/C2=CC(=C(C=C2)OC(=O)C3=CC=C(C=C3)F)OC)/C#N

InChI

InChI=1S/C21H15FN2O3S/c1-13-12-28-20(24-13)16(11-23)9-14-3-8-18(19(10-14)26-2)27-21(25)15-4-6-17(22)7-5-15/h3-10,12H,1-2H3/b16-9+