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

Systemtic Name: prop-2-enyl (E)-3-[2-(3-bromophenyl)-1,3-thiazol-4-yl]-2-cyano-prop-2-enoate Openeye Name: allyl (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 prop-2-enyl ester IUPAC Name: prop-2-enyl (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 allyl ester Formula: C16H11BrN2O2S MolecularWeight: 375.23974

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11BrN2O2S/c1-2-6-21-16(20)12(9-18)8-14-10-22-15(19-14)11-4-3-5-13(17)7-11/h2-5,7-8,10H,1,6H2/b12-8+