3-[(2-chloranyl-4-phenyl-phenyl)methyl]-2-methyl-N-pentylsulfonyl-benzimidazole-5-carboxamide

Systemtic Name: 3-[(2-chloranyl-4-phenyl-phenyl)methyl]-2-methyl-N-pentylsulfonyl-benzimidazole-5-carboxamide Openeye Name: 3-[(2-chloro-4-phenyl-phenyl)methyl]-2-methyl-N-pentylsulfonyl-benzimidazole-5-carboxamide CAS Name: 3-[(2-chloro-4-phenylphenyl)methyl]-2-methyl-N-pentylsulfonyl-5-benzimidazolecarboxamide IUPAC Name: 3-[(2-chloro-4-phenylphenyl)methyl]-2-methyl-N-pentylsulfonylbenzimidazole-5-carboxamide Traditional Name: N-amylsulfonyl-3-(2-chloro-4-phenyl-benzyl)-2-methyl-benzimidazole-5-carboxamide Formula: C27H28ClN3O3S MolecularWeight: 510.04752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCS(=O)(=O)NC(=O)C1=CC2=C(C=C1)N=C(N2CC3=C(C=C(C=C3)C4=CC=CC=C4)Cl)C

Isomeric SMILES

CCCCCS(=O)(=O)NC(=O)C1=CC2=C(C=C1)N=C(N2CC3=C(C=C(C=C3)C4=CC=CC=C4)Cl)C

InChI

InChI=1S/C27H28ClN3O3S/c1-3-4-8-15-35(33,34)30-27(32)22-13-14-25-26(17-22)31(19(2)29-25)18-23-12-11-21(16-24(23)28)20-9-6-5-7-10-20/h5-7,9-14,16-17H,3-4,8,15,18H2,1-2H3,(H,30,32)