5-azanyl-4-[[2-azanyl-2-methyl-4-[2-[(4-methylphenyl)sulfonylamino]cyclohexyl]oxy-3-oxidanylidene-butanoyl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-4-[[2-azanyl-2-methyl-4-[2-[(4-methylphenyl)sulfonylamino]cyclohexyl]oxy-3-oxidanylidene-butanoyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-4-[[2-amino-2-methyl-3-oxo-4-[2-(p-tolylsulfonylamino)cyclohexoxy]butanoyl]amino]-5-oxo-pentanoic acid CAS Name: 5-amino-4-[[2-amino-2-methyl-4-[2-[(4-methylphenyl)sulfonylamino]cyclohexyl]oxy-1,3-dioxobutyl]amino]-5-oxopentanoic acid IUPAC Name: 5-amino-4-[[2-amino-2-methyl-4-[2-[(4-methylphenyl)sulfonylamino]cyclohexyl]oxy-3-oxobutanoyl]amino]-5-oxopentanoic acid Traditional Name: 5-amino-4-[[2-amino-3-keto-2-methyl-4-[2-(tosylamino)cyclohexoxy]butanoyl]amino]-5-keto-valeric acid Formula: C23H34N4O8S MolecularWeight: 526.60306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2CCCCC2OCC(=O)C(C)(C(=O)NC(CCC(=O)O)C(=O)N)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2CCCCC2OCC(=O)C(C)(C(=O)NC(CCC(=O)O)C(=O)N)N

InChI

InChI=1S/C23H34N4O8S/c1-14-7-9-15(10-8-14)36(33,34)27-16-5-3-4-6-18(16)35-13-19(28)23(2,25)22(32)26-17(21(24)31)11-12-20(29)30/h7-10,16-18,27H,3-6,11-13,25H2,1-2H3,(H2,24,31)(H,26,32)(H,29,30)