[5-[[6-(butanoylamino)-2-butyl-benzimidazol-1-yl]methyl]-2-phenyl-phenyl] N-methylsulfonylcarbamate

Systemtic Name: [5-[[6-(butanoylamino)-2-butyl-benzimidazol-1-yl]methyl]-2-phenyl-phenyl] N-methylsulfonylcarbamate Openeye Name: [5-[[6-(butanoylamino)-2-butyl-benzimidazol-1-yl]methyl]-2-phenyl-phenyl] N-methylsulfonylcarbamate CAS Name: N-methylsulfonylcarbamic acid [5-[[2-butyl-6-(1-oxobutylamino)-1-benzimidazolyl]methyl]-2-phenylphenyl] ester IUPAC Name: [5-[[6-(butanoylamino)-2-butylbenzimidazol-1-yl]methyl]-2-phenylphenyl] N-methylsulfonylcarbamate Traditional Name: N-mesylcarbamic acid [5-[(2-butyl-6-butyramido-benzimidazol-1-yl)methyl]-2-phenyl-phenyl] ester Formula: C30H34N4O5S MolecularWeight: 562.67976

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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)C)C=C(C=C2)NC(=O)CCC

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC(=C(C=C3)C4=CC=CC=C4)OC(=O)NS(=O)(=O)C)C=C(C=C2)NC(=O)CCC

InChI

InChI=1S/C30H34N4O5S/c1-4-6-13-28-32-25-17-15-23(31-29(35)10-5-2)19-26(25)34(28)20-21-14-16-24(22-11-8-7-9-12-22)27(18-21)39-30(36)33-40(3,37)38/h7-9,11-12,14-19H,4-6,10,13,20H2,1-3H3,(H,31,35)(H,33,36)