3-[[2-chloranyl-4-(phenoxymethyl)phenyl]methyl]-2-methyl-N-(3-methylphenyl)sulfonyl-benzimidazole-5-carboxamide

Systemtic Name: 3-[[2-chloranyl-4-(phenoxymethyl)phenyl]methyl]-2-methyl-N-(3-methylphenyl)sulfonyl-benzimidazole-5-carboxamide Openeye Name: 3-[[2-chloro-4-(phenoxymethyl)phenyl]methyl]-2-methyl-N-(m-tolylsulfonyl)benzimidazole-5-carboxamide CAS Name: 3-[[2-chloro-4-(phenoxymethyl)phenyl]methyl]-2-methyl-N-(3-methylphenyl)sulfonyl-5-benzimidazolecarboxamide IUPAC Name: 3-[[2-chloro-4-(phenoxymethyl)phenyl]methyl]-2-methyl-N-(3-methylphenyl)sulfonylbenzimidazole-5-carboxamide Traditional Name: 3-[2-chloro-4-(phenoxymethyl)benzyl]-2-methyl-N-(m-tolylsulfonyl)benzimidazole-5-carboxamide Formula: C30H26ClN3O4S MolecularWeight: 560.06314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)NC(=O)C2=CC3=C(C=C2)N=C(N3CC4=C(C=C(C=C4)COC5=CC=CC=C5)Cl)C

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)NC(=O)C2=CC3=C(C=C2)N=C(N3CC4=C(C=C(C=C4)COC5=CC=CC=C5)Cl)C

InChI

InChI=1S/C30H26ClN3O4S/c1-20-7-6-10-26(15-20)39(36,37)33-30(35)23-13-14-28-29(17-23)34(21(2)32-28)18-24-12-11-22(16-27(24)31)19-38-25-8-4-3-5-9-25/h3-17H,18-19H2,1-2H3,(H,33,35)