methyl 4-[(Z)-2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-cyano-ethenyl]benzoate

Systemtic Name: methyl 4-[(Z)-2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-cyano-ethenyl]benzoate Openeye Name: methyl 4-[(Z)-2-[4-(4-bromophenyl)thiazol-2-yl]-2-cyano-vinyl]benzoate CAS Name: 4-[(Z)-2-[4-(4-bromophenyl)-2-thiazolyl]-2-cyanoethenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(Z)-2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-cyanoethenyl]benzoate Traditional Name: 4-[(Z)-2-[4-(4-bromophenyl)thiazol-2-yl]-2-cyano-vinyl]benzoic acid methyl ester Formula: C20H13BrN2O2S MolecularWeight: 425.29842

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=C(C#N)C2=NC(=CS2)C3=CC=C(C=C3)Br

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C(/C#N)\C2=NC(=CS2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H13BrN2O2S/c1-25-20(24)15-4-2-13(3-5-15)10-16(11-22)19-23-18(12-26-19)14-6-8-17(21)9-7-14/h2-10,12H,1H3/b16-10-