2-[[2,6-bis(chloranyl)phenyl]amino]-7-bromanyl-3-methyl-5-(2-methyl-3-oxidanylidene-butan-2-yl)benzimidazole-4-carbonitrile

Systemtic Name: 2-[[2,6-bis(chloranyl)phenyl]amino]-7-bromanyl-3-methyl-5-(2-methyl-3-oxidanylidene-butan-2-yl)benzimidazole-4-carbonitrile Openeye Name: 7-bromo-2-(2,6-dichloroanilino)-5-(1,1-dimethyl-2-oxo-propyl)-3-methyl-benzimidazole-4-carbonitrile CAS Name: 7-bromo-2-(2,6-dichloroanilino)-3-methyl-5-(2-methyl-3-oxobutan-2-yl)-4-benzimidazolecarbonitrile IUPAC Name: 7-bromo-2-(2,6-dichloroanilino)-3-methyl-5-(2-methyl-3-oxobutan-2-yl)benzimidazole-4-carbonitrile Traditional Name: 7-bromo-2-(2,6-dichloroanilino)-5-(2-keto-1,1-dimethyl-propyl)-3-methyl-benzimidazole-4-carbonitrile Formula: C20H17BrCl2N4O MolecularWeight: 480.18518

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C)(C)C1=CC(=C2C(=C1C#N)N(C(=N2)NC3=C(C=CC=C3Cl)Cl)C)Br

Isomeric SMILES

CC(=O)C(C)(C)C1=CC(=C2C(=C1C#N)N(C(=N2)NC3=C(C=CC=C3Cl)Cl)C)Br

InChI

InChI=1S/C20H17BrCl2N4O/c1-10(28)20(2,3)12-8-13(21)16-18(11(12)9-24)27(4)19(25-16)26-17-14(22)6-5-7-15(17)23/h5-8H,1-4H3,(H,25,26)