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

Systemtic Name: 3-[(2-chloranyl-4-thiophen-2-yl-phenyl)methyl]-2-methyl-N-(4-methylphenyl)sulfonyl-benzimidazole-5-carboxamide Openeye Name: 3-[[2-chloro-4-(2-thienyl)phenyl]methyl]-2-methyl-N-(p-tolylsulfonyl)benzimidazole-5-carboxamide CAS Name: 3-[(2-chloro-4-thiophen-2-ylphenyl)methyl]-2-methyl-N-(4-methylphenyl)sulfonyl-5-benzimidazolecarboxamide IUPAC Name: 3-[(2-chloro-4-thiophen-2-ylphenyl)methyl]-2-methyl-N-(4-methylphenyl)sulfonylbenzimidazole-5-carboxamide Traditional Name: 3-[2-chloro-4-(2-thienyl)benzyl]-2-methyl-N-tosyl-benzimidazole-5-carboxamide Formula: C27H22ClN3O3S2 MolecularWeight: 536.06488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=CC3=C(C=C2)N=C(N3CC4=C(C=C(C=C4)C5=CC=CS5)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=CC3=C(C=C2)N=C(N3CC4=C(C=C(C=C4)C5=CC=CS5)Cl)C

InChI

InChI=1S/C27H22ClN3O3S2/c1-17-5-10-22(11-6-17)36(33,34)30-27(32)20-9-12-24-25(15-20)31(18(2)29-24)16-21-8-7-19(14-23(21)28)26-4-3-13-35-26/h3-15H,16H2,1-2H3,(H,30,32)