methyl (E)-3-[2-(3-bromophenyl)-1,3-thiazol-4-yl]-2-cyano-prop-2-enoate

Systemtic Name: methyl (E)-3-[2-(3-bromophenyl)-1,3-thiazol-4-yl]-2-cyano-prop-2-enoate Openeye Name: methyl (E)-3-[2-(3-bromophenyl)thiazol-4-yl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[2-(3-bromophenyl)-4-thiazolyl]-2-cyano-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[2-(3-bromophenyl)-1,3-thiazol-4-yl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[2-(3-bromophenyl)thiazol-4-yl]-2-cyano-acrylic acid methyl ester Formula: C14H9BrN2O2S MolecularWeight: 349.20246

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC1=CSC(=N1)C2=CC(=CC=C2)Br)C#N

Isomeric SMILES

COC(=O)/C(=C/C1=CSC(=N1)C2=CC(=CC=C2)Br)/C#N

InChI

InChI=1S/C14H9BrN2O2S/c1-19-14(18)10(7-16)6-12-8-20-13(17-12)9-3-2-4-11(15)5-9/h2-6,8H,1H3/b10-6+