(E)-3-[5-bromanyl-1-(4-methoxyphenyl)-2-methylsulfanyl-imidazol-4-yl]prop-2-enal

Systemtic Name: (E)-3-[5-bromanyl-1-(4-methoxyphenyl)-2-methylsulfanyl-imidazol-4-yl]prop-2-enal Openeye Name: (E)-3-[5-bromo-1-(4-methoxyphenyl)-2-methylsulfanyl-imidazol-4-yl]prop-2-enal CAS Name: (E)-3-[5-bromo-1-(4-methoxyphenyl)-2-(methylthio)-4-imidazolyl]-2-propenal IUPAC Name: (E)-3-[5-bromo-1-(4-methoxyphenyl)-2-methylsulfanylimidazol-4-yl]prop-2-enal Traditional Name: (E)-3-[5-bromo-1-(4-methoxyphenyl)-2-(methylthio)imidazol-4-yl]acrolein Formula: C14H13BrN2O2S MolecularWeight: 353.23422

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=C(N=C2SC)C=CC=O)Br

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=C(N=C2SC)/C=C/C=O)Br

InChI

InChI=1S/C14H13BrN2O2S/c1-19-11-7-5-10(6-8-11)17-13(15)12(4-3-9-18)16-14(17)20-2/h3-9H,1-2H3/b4-3+