1-tert-butyl-3-[(3-chloranyl-4-methoxy-phenyl)methyl]-2-oxidanylidene-benzimidazole-5-carbonitrile

Systemtic Name: 1-tert-butyl-3-[(3-chloranyl-4-methoxy-phenyl)methyl]-2-oxidanylidene-benzimidazole-5-carbonitrile Openeye Name: 1-tert-butyl-3-[(3-chloro-4-methoxy-phenyl)methyl]-2-oxo-benzimidazole-5-carbonitrile CAS Name: 1-tert-butyl-3-[(3-chloro-4-methoxyphenyl)methyl]-2-oxo-5-benzimidazolecarbonitrile IUPAC Name: 1-tert-butyl-3-[(3-chloro-4-methoxyphenyl)methyl]-2-oxobenzimidazole-5-carbonitrile Traditional Name: 1-tert-butyl-3-(3-chloro-4-methoxy-benzyl)-2-keto-benzimidazole-5-carbonitrile Formula: C20H20ClN3O2 MolecularWeight: 369.8447

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C2=C(C=C(C=C2)C#N)N(C1=O)CC3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

CC(C)(C)N1C2=C(C=C(C=C2)C#N)N(C1=O)CC3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C20H20ClN3O2/c1-20(2,3)24-16-7-5-13(11-22)10-17(16)23(19(24)25)12-14-6-8-18(26-4)15(21)9-14/h5-10H,12H2,1-4H3