[5-[[4-(butanoylamino)-2-butyl-benzimidazol-1-yl]methyl]-2-phenyl-phenyl] N-(phenylsulfonyl)carbamate

Systemtic Name: [5-[[4-(butanoylamino)-2-butyl-benzimidazol-1-yl]methyl]-2-phenyl-phenyl] N-(phenylsulfonyl)carbamate Openeye Name: [5-[[4-(butanoylamino)-2-butyl-benzimidazol-1-yl]methyl]-2-phenyl-phenyl] N-(benzenesulfonyl)carbamate CAS Name: N-(benzenesulfonyl)carbamic acid [5-[[2-butyl-4-(1-oxobutylamino)-1-benzimidazolyl]methyl]-2-phenylphenyl] ester IUPAC Name: [5-[[4-(butanoylamino)-2-butylbenzimidazol-1-yl]methyl]-2-phenylphenyl] N-(benzenesulfonyl)carbamate Traditional Name: N-besylcarbamic acid [5-[(2-butyl-4-butyramido-benzimidazol-1-yl)methyl]-2-phenyl-phenyl] ester Formula: C35H36N4O5S MolecularWeight: 624.74914

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC(=C(C=C3)C4=CC=CC=C4)OC(=O)NS(=O)(=O)C5=CC=CC=C5)C=CC=C2NC(=O)CCC

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC(=C(C=C3)C4=CC=CC=C4)OC(=O)NS(=O)(=O)C5=CC=CC=C5)C=CC=C2NC(=O)CCC

InChI

InChI=1S/C35H36N4O5S/c1-3-5-20-32-37-34-29(36-33(40)13-4-2)18-12-19-30(34)39(32)24-25-21-22-28(26-14-8-6-9-15-26)31(23-25)44-35(41)38-45(42,43)27-16-10-7-11-17-27/h6-12,14-19,21-23H,3-5,13,20,24H2,1-2H3,(H,36,40)(H,38,41)