3-[(2-chlorophenyl)methyl]-2-methyl-N-(3-methylbutylsulfonyl)benzimidazole-5-carboxamide

Systemtic Name: 3-[(2-chlorophenyl)methyl]-2-methyl-N-(3-methylbutylsulfonyl)benzimidazole-5-carboxamide Openeye Name: 3-[(2-chlorophenyl)methyl]-N-isopentylsulfonyl-2-methyl-benzimidazole-5-carboxamide CAS Name: 3-[(2-chlorophenyl)methyl]-2-methyl-N-(3-methylbutylsulfonyl)-5-benzimidazolecarboxamide IUPAC Name: 3-[(2-chlorophenyl)methyl]-2-methyl-N-(3-methylbutylsulfonyl)benzimidazole-5-carboxamide Traditional Name: 3-(2-chlorobenzyl)-N-isoamylsulfonyl-2-methyl-benzimidazole-5-carboxamide Formula: C21H24ClN3O3S MolecularWeight: 433.95156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1CC3=CC=CC=C3Cl)C=C(C=C2)C(=O)NS(=O)(=O)CCC(C)C

Isomeric SMILES

CC1=NC2=C(N1CC3=CC=CC=C3Cl)C=C(C=C2)C(=O)NS(=O)(=O)CCC(C)C

InChI

InChI=1S/C21H24ClN3O3S/c1-14(2)10-11-29(27,28)24-21(26)16-8-9-19-20(12-16)25(15(3)23-19)13-17-6-4-5-7-18(17)22/h4-9,12,14H,10-11,13H2,1-3H3,(H,24,26)