3-methyl-2-[[1-[3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoyl]piperidin-4-yl]carbonylamino]pentanoic acid

Systemtic Name: 3-methyl-2-[[1-[3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoyl]piperidin-4-yl]carbonylamino]pentanoic acid Openeye Name: 3-methyl-2-[[1-[3-methyl-2-(p-tolylsulfonylamino)butanoyl]piperidine-4-carbonyl]amino]pentanoic acid CAS Name: 3-methyl-2-[[[1-[3-methyl-2-[(4-methylphenyl)sulfonylamino]-1-oxobutyl]-4-piperidinyl]-oxomethyl]amino]pentanoic acid IUPAC Name: 3-methyl-2-[[1-[3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoyl]piperidine-4-carbonyl]amino]pentanoic acid Traditional Name: 3-methyl-2-[[1-[3-methyl-2-(tosylamino)butanoyl]isonipecotoyl]amino]valeric acid Formula: C24H37N3O6S MolecularWeight: 495.63208

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)C1CCN(CC1)C(=O)C(C(C)C)NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCC(C)C(C(=O)O)NC(=O)C1CCN(CC1)C(=O)C(C(C)C)NS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C24H37N3O6S/c1-6-17(5)21(24(30)31)25-22(28)18-11-13-27(14-12-18)23(29)20(15(2)3)26-34(32,33)19-9-7-16(4)8-10-19/h7-10,15,17-18,20-21,26H,6,11-14H2,1-5H3,(H,25,28)(H,30,31)