1-[5-bromanyl-2-methylsulfanyl-1-(4-phenylmethoxyphenyl)imidazol-4-yl]-2-methyl-prop-2-en-1-one

Systemtic Name: 1-[5-bromanyl-2-methylsulfanyl-1-(4-phenylmethoxyphenyl)imidazol-4-yl]-2-methyl-prop-2-en-1-one Openeye Name: 1-[1-(4-benzyloxyphenyl)-5-bromo-2-methylsulfanyl-imidazol-4-yl]-2-methyl-prop-2-en-1-one CAS Name: 1-[5-bromo-2-(methylthio)-1-(4-phenylmethoxyphenyl)-4-imidazolyl]-2-methyl-2-propen-1-one IUPAC Name: 1-[5-bromo-2-methylsulfanyl-1-(4-phenylmethoxyphenyl)imidazol-4-yl]-2-methylprop-2-en-1-one Traditional Name: 1-[1-(4-benzoxyphenyl)-5-bromo-2-(methylthio)imidazol-4-yl]-2-methyl-prop-2-en-1-one Formula: C21H19BrN2O2S MolecularWeight: 443.35676

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)C1=C(N(C(=N1)SC)C2=CC=C(C=C2)OCC3=CC=CC=C3)Br

Isomeric SMILES

CC(=C)C(=O)C1=C(N(C(=N1)SC)C2=CC=C(C=C2)OCC3=CC=CC=C3)Br

InChI

InChI=1S/C21H19BrN2O2S/c1-14(2)19(25)18-20(22)24(21(23-18)27-3)16-9-11-17(12-10-16)26-13-15-7-5-4-6-8-15/h4-12H,1,13H2,2-3H3