N-[2-tert-butyl-1-(oxan-4-ylmethyl)benzimidazol-5-yl]-N-methyl-4-(phenylcarbonyl)piperazine-1-sulfonamide

Systemtic Name: N-[2-tert-butyl-1-(oxan-4-ylmethyl)benzimidazol-5-yl]-N-methyl-4-(phenylcarbonyl)piperazine-1-sulfonamide Openeye Name: 4-benzoyl-N-[2-tert-butyl-1-(tetrahydropyran-4-ylmethyl)benzimidazol-5-yl]-N-methyl-piperazine-1-sulfonamide CAS Name: 4-benzoyl-N-[2-tert-butyl-1-(4-oxanylmethyl)-5-benzimidazolyl]-N-methyl-1-piperazinesulfonamide IUPAC Name: 4-benzoyl-N-[2-tert-butyl-1-(oxan-4-ylmethyl)benzimidazol-5-yl]-N-methylpiperazine-1-sulfonamide Traditional Name: 4-benzoyl-N-[2-tert-butyl-1-(tetrahydropyran-4-ylmethyl)benzimidazol-5-yl]-N-methyl-piperazine-1-sulfonamide Formula: C29H39N5O4S MolecularWeight: 553.71606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=C(N1CC3CCOCC3)C=CC(=C2)N(C)S(=O)(=O)N4CCN(CC4)C(=O)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)C1=NC2=C(N1CC3CCOCC3)C=CC(=C2)N(C)S(=O)(=O)N4CCN(CC4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C29H39N5O4S/c1-29(2,3)28-30-25-20-24(10-11-26(25)34(28)21-22-12-18-38-19-13-22)31(4)39(36,37)33-16-14-32(15-17-33)27(35)23-8-6-5-7-9-23/h5-11,20,22H,12-19,21H2,1-4H3