1-[(4-tert-butylphenyl)methyl]-2-(2-chloranylpyridin-3-yl)-5,6-dimethyl-benzimidazole

Systemtic Name: 1-[(4-tert-butylphenyl)methyl]-2-(2-chloranylpyridin-3-yl)-5,6-dimethyl-benzimidazole Openeye Name: 1-[(4-tert-butylphenyl)methyl]-2-(2-chloro-3-pyridyl)-5,6-dimethyl-benzimidazole CAS Name: 1-[(4-tert-butylphenyl)methyl]-2-(2-chloro-3-pyridinyl)-5,6-dimethylbenzimidazole IUPAC Name: 1-[(4-tert-butylphenyl)methyl]-2-(2-chloropyridin-3-yl)-5,6-dimethylbenzimidazole Traditional Name: 1-(4-tert-butylbenzyl)-2-(2-chloro-3-pyridyl)-5,6-dimethyl-benzimidazole Formula: C25H26ClN3 MolecularWeight: 403.94704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C(=N2)C3=C(N=CC=C3)Cl)CC4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C(=N2)C3=C(N=CC=C3)Cl)CC4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C25H26ClN3/c1-16-13-21-22(14-17(16)2)29(24(28-21)20-7-6-12-27-23(20)26)15-18-8-10-19(11-9-18)25(3,4)5/h6-14H,15H2,1-5H3