2-[[[2-(2-imidazol-1-ylethanoyl)-4-methyl-pentanoyl]amino]-[1-(oxidanylamino)-1-oxidanylidene-5-phenyl-2-(phenylmethyl)pentan-2-yl]amino]-4-methyl-benzenesulfonate

Systemtic Name: 2-[[[2-(2-imidazol-1-ylethanoyl)-4-methyl-pentanoyl]amino]-[1-(oxidanylamino)-1-oxidanylidene-5-phenyl-2-(phenylmethyl)pentan-2-yl]amino]-4-methyl-benzenesulfonate Openeye Name: 2-[[1-benzyl-1-(hydroxycarbamoyl)-4-phenyl-butyl]-[[2-(2-imidazol-1-ylacetyl)-4-methyl-pentanoyl]amino]amino]-4-methyl-benzenesulfonate CAS Name: 2-[[1-(hydroxyamino)-1-oxo-5-phenyl-2-(phenylmethyl)pentan-2-yl]-[[2-[2-(1-imidazolyl)-1-oxoethyl]-4-methyl-1-oxopentyl]amino]amino]-4-methylbenzenesulfonate IUPAC Name: 2-[[2-benzyl-1-(hydroxyamino)-1-oxo-5-phenylpentan-2-yl]-[[2-(2-imidazol-1-ylacetyl)-4-methylpentanoyl]amino]amino]-4-methylbenzenesulfonate Traditional Name: 2-[[1-benzyl-1-(hydroxycarbamoyl)-4-phenyl-butyl]-[[2-(2-imidazol-1-ylacetyl)-4-methyl-pentanoyl]amino]amino]-4-methyl-besylate Formula: C36H42N5O7S- MolecularWeight: 688.81298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)[O-])N(C(CCCC2=CC=CC=C2)(CC3=CC=CC=C3)C(=O)NO)NC(=O)C(CC(C)C)C(=O)CN4C=CN=C4

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)[O-])N(C(CCCC2=CC=CC=C2)(CC3=CC=CC=C3)C(=O)NO)NC(=O)C(CC(C)C)C(=O)CN4C=CN=C4

InChI

InChI=1S/C36H43N5O7S/c1-26(2)21-30(32(42)24-40-20-19-37-25-40)34(43)38-41(31-22-27(3)16-17-33(31)49(46,47)48)36(35(44)39-45,23-29-13-8-5-9-14-29)18-10-15-28-11-6-4-7-12-28/h4-9,11-14,16-17,19-20,22,25-26,30,45H,10,15,18,21,23-24H2,1-3H3,(H,38,43)(H,39,44)(H,46,47,48)/p-1