2-[3H-benzimidazol-5-ylmethyl-(4-methylphenyl)peroxysulfanyl-amino]-3-methyl-N-oxidanyl-butanamide

Systemtic Name: 2-[3H-benzimidazol-5-ylmethyl-(4-methylphenyl)peroxysulfanyl-amino]-3-methyl-N-oxidanyl-butanamide Openeye Name: 2-[3H-benzimidazol-5-ylmethyl(p-tolylperoxysulfanyl)amino]-3-methyl-butanehydroxamic acid CAS Name: 2-[3H-benzimidazol-5-ylmethyl-[(4-methylphenyl)dioxythio]amino]-N-hydroxy-3-methylbutanamide IUPAC Name: 2-[3H-benzimidazol-5-ylmethyl-(4-methylphenyl)peroxysulfanylamino]-N-hydroxy-3-methylbutanamide Traditional Name: 2-[3H-benzimidazol-5-ylmethyl-(p-tolylperoxythio)amino]-3-methyl-butanehydroxamic acid Formula: C20H24N4O4S MolecularWeight: 416.49396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OOSN(CC2=CC3=C(C=C2)N=CN3)C(C(C)C)C(=O)NO

Isomeric SMILES

CC1=CC=C(C=C1)OOSN(CC2=CC3=C(C=C2)N=CN3)C(C(C)C)C(=O)NO

InChI

InChI=1S/C20H24N4O4S/c1-13(2)19(20(25)23-26)24(29-28-27-16-7-4-14(3)5-8-16)11-15-6-9-17-18(10-15)22-12-21-17/h4-10,12-13,19,26H,11H2,1-3H3,(H,21,22)(H,23,25)