methyl 5-bromanyl-2-[[(E)-2-cyano-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]amino]benzoate

Systemtic Name: methyl 5-bromanyl-2-[[(E)-2-cyano-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]amino]benzoate Openeye Name: methyl 5-bromo-2-[[(E)-2-cyano-2-(4-methylthiazol-2-yl)vinyl]amino]benzoate CAS Name: 5-bromo-2-[[(E)-2-cyano-2-(4-methyl-2-thiazolyl)ethenyl]amino]benzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-[[(E)-2-cyano-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]amino]benzoate Traditional Name: 5-bromo-2-[[(E)-2-cyano-2-(4-methylthiazol-2-yl)vinyl]amino]benzoic acid methyl ester Formula: C15H12BrN3O2S MolecularWeight: 378.24368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(=CNC2=C(C=C(C=C2)Br)C(=O)OC)C#N

Isomeric SMILES

CC1=CSC(=N1)/C(=C/NC2=C(C=C(C=C2)Br)C(=O)OC)/C#N

InChI

InChI=1S/C15H12BrN3O2S/c1-9-8-22-14(19-9)10(6-17)7-18-13-4-3-11(16)5-12(13)15(20)21-2/h3-5,7-8,18H,1-2H3/b10-7+