1-(5-chloranyl-2-methoxy-phenyl)-3-[[1-(3-methylbutyl)benzimidazol-2-yl]methyl]benzimidazol-2-one

Systemtic Name: 1-(5-chloranyl-2-methoxy-phenyl)-3-[[1-(3-methylbutyl)benzimidazol-2-yl]methyl]benzimidazol-2-one Openeye Name: 1-(5-chloro-2-methoxy-phenyl)-3-[(1-isopentylbenzimidazol-2-yl)methyl]benzimidazol-2-one CAS Name: 1-(5-chloro-2-methoxyphenyl)-3-[[1-(3-methylbutyl)-2-benzimidazolyl]methyl]-2-benzimidazolone IUPAC Name: 1-(5-chloro-2-methoxyphenyl)-3-[[1-(3-methylbutyl)benzimidazol-2-yl]methyl]benzimidazol-2-one Traditional Name: 1-(5-chloro-2-methoxy-phenyl)-3-[(1-isoamylbenzimidazol-2-yl)methyl]benzimidazol-2-one Formula: C27H27ClN4O2 MolecularWeight: 474.98188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=CC=CC=C2N=C1CN3C4=CC=CC=C4N(C3=O)C5=C(C=CC(=C5)Cl)OC

Isomeric SMILES

CC(C)CCN1C2=CC=CC=C2N=C1CN3C4=CC=CC=C4N(C3=O)C5=C(C=CC(=C5)Cl)OC

InChI

InChI=1S/C27H27ClN4O2/c1-18(2)14-15-30-21-9-5-4-8-20(21)29-26(30)17-31-22-10-6-7-11-23(22)32(27(31)33)24-16-19(28)12-13-25(24)34-3/h4-13,16,18H,14-15,17H2,1-3H3