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

Systemtic Name: 1-[1-[3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoyl]piperidin-4-yl]carbonylpyrrolidine-2-carboxylic acid Openeye Name: 1-[1-[3-methyl-2-(p-tolylsulfonylamino)butanoyl]piperidine-4-carbonyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[[1-[3-methyl-2-[(4-methylphenyl)sulfonylamino]-1-oxobutyl]-4-piperidinyl]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[1-[3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoyl]piperidine-4-carbonyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[1-[3-methyl-2-(tosylamino)butanoyl]isonipecotoyl]proline Formula: C23H33N3O6S MolecularWeight: 479.58962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)N2CCC(CC2)C(=O)N3CCCC3C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)N2CCC(CC2)C(=O)N3CCCC3C(=O)O

InChI

InChI=1S/C23H33N3O6S/c1-15(2)20(24-33(31,32)18-8-6-16(3)7-9-18)22(28)25-13-10-17(11-14-25)21(27)26-12-4-5-19(26)23(29)30/h6-9,15,17,19-20,24H,4-5,10-14H2,1-3H3,(H,29,30)