N-butylsulfonyl-2-methyl-3-[(4-phenethylphenyl)methyl]benzimidazole-5-carboxamide

Systemtic Name: N-butylsulfonyl-2-methyl-3-[(4-phenethylphenyl)methyl]benzimidazole-5-carboxamide Openeye Name: N-butylsulfonyl-2-methyl-3-[(4-phenethylphenyl)methyl]benzimidazole-5-carboxamide CAS Name: N-butylsulfonyl-2-methyl-3-[(4-phenethylphenyl)methyl]-5-benzimidazolecarboxamide IUPAC Name: N-butylsulfonyl-2-methyl-3-[(4-phenethylphenyl)methyl]benzimidazole-5-carboxamide Traditional Name: N-butylsulfonyl-2-methyl-3-(4-phenethylbenzyl)benzimidazole-5-carboxamide Formula: C28H31N3O3S MolecularWeight: 489.62904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC(=O)C1=CC2=C(C=C1)N=C(N2CC3=CC=C(C=C3)CCC4=CC=CC=C4)C

Isomeric SMILES

CCCCS(=O)(=O)NC(=O)C1=CC2=C(C=C1)N=C(N2CC3=CC=C(C=C3)CCC4=CC=CC=C4)C

InChI

InChI=1S/C28H31N3O3S/c1-3-4-18-35(33,34)30-28(32)25-16-17-26-27(19-25)31(21(2)29-26)20-24-14-12-23(13-15-24)11-10-22-8-6-5-7-9-22/h5-9,12-17,19H,3-4,10-11,18,20H2,1-2H3,(H,30,32)