2-[[2-azanylpropanoyl(2-methylpropyl)amino]-(4-methylpentanoyl)amino]-N-oxidanyl-6-phenyl-hexanamide; 4-methylbenzenesulfonic acid

Systemtic Name: 2-[[2-azanylpropanoyl(2-methylpropyl)amino]-(4-methylpentanoyl)amino]-N-oxidanyl-6-phenyl-hexanamide; 4-methylbenzenesulfonic acid Openeye Name: 2-[[2-aminopropanoyl(isobutyl)amino]-(4-methylpentanoyl)amino]-6-phenyl-hexanehydroxamic acid; 4-methylbenzenesulfonic acid CAS Name: 2-[[(2-amino-1-oxopropyl)-(2-methylpropyl)amino]-(4-methyl-1-oxopentyl)amino]-N-hydroxy-6-phenylhexanamide; 4-methylbenzenesulfonic acid IUPAC Name: 2-[[2-aminopropanoyl(2-methylpropyl)amino]-(4-methylpentanoyl)amino]-N-hydroxy-6-phenylhexanamide; 4-methylbenzenesulfonic acid Traditional Name: 2-[[alanyl(isobutyl)amino]-(4-methylpentanoyl)amino]-6-phenyl-hexanehydroxamic acid; tosylic acid Formula: C32H50N4O7S MolecularWeight: 634.827

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.CC(C)CCC(=O)N(C(CCCCC1=CC=CC=C1)C(=O)NO)N(CC(C)C)C(=O)C(C)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.CC(C)CCC(=O)N(C(CCCCC1=CC=CC=C1)C(=O)NO)N(CC(C)C)C(=O)C(C)N

InChI

InChI=1S/C25H42N4O4.C7H8O3S/c1-18(2)15-16-23(30)29(28(17-19(3)4)25(32)20(5)26)22(24(31)27-33)14-10-9-13-21-11-7-6-8-12-21;1-6-2-4-7(5-3-6)11(8,9)10/h6-8,11-12,18-20,22,33H,9-10,13-17,26H2,1-5H3,(H,27,31);2-5H,1H3,(H,8,9,10)