6-[[[5-(1H-benzimidazol-2-yl)-2-methyl-phenyl]amino]methylidene]-2-bromanyl-4-(phenylmethyl)cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[[5-(1H-benzimidazol-2-yl)-2-methyl-phenyl]amino]methylidene]-2-bromanyl-4-(phenylmethyl)cyclohexa-2,4-dien-1-one Openeye Name: 6-[[5-(1H-benzimidazol-2-yl)-2-methyl-anilino]methylene]-4-benzyl-2-bromo-cyclohexa-2,4-dien-1-one CAS Name: 6-[[5-(1H-benzimidazol-2-yl)-2-methylanilino]methylidene]-2-bromo-4-(phenylmethyl)-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[5-(1H-benzimidazol-2-yl)-2-methylanilino]methylidene]-4-benzyl-2-bromocyclohexa-2,4-dien-1-one Traditional Name: 6-[[5-(1H-benzimidazol-2-yl)-2-methyl-anilino]methylene]-4-benzyl-2-bromo-cyclohexa-2,4-dien-1-one Formula: C28H22BrN3O MolecularWeight: 496.39778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3N2)NC=C4C=C(C=C(C4=O)Br)CC5=CC=CC=C5

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3N2)NC=C4C=C(C=C(C4=O)Br)CC5=CC=CC=C5

InChI

InChI=1S/C28H22BrN3O/c1-18-11-12-21(28-31-24-9-5-6-10-25(24)32-28)16-26(18)30-17-22-14-20(15-23(29)27(22)33)13-19-7-3-2-4-8-19/h2-12,14-17,30H,13H2,1H3,(H,31,32)