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

Systemtic Name: propan-2-yl (E)-3-[2-(3-bromophenyl)-1,3-thiazol-4-yl]-2-cyano-prop-2-enoate Openeye Name: isopropyl (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 propan-2-yl ester IUPAC Name: propan-2-yl (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 isopropyl ester Formula: C16H13BrN2O2S MolecularWeight: 377.25562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13BrN2O2S/c1-10(2)21-16(20)12(8-18)7-14-9-22-15(19-14)11-4-3-5-13(17)6-11/h3-7,9-10H,1-2H3/b12-7+