methyl 1-[1-(2,5-dimethylpyrazol-3-yl)carbonyl-4-[(1-methylimidazol-4-yl)sulfonylamino]piperidin-2-yl]carbonylpyrrolidine-2-carboxylate

Systemtic Name: methyl 1-[1-(2,5-dimethylpyrazol-3-yl)carbonyl-4-[(1-methylimidazol-4-yl)sulfonylamino]piperidin-2-yl]carbonylpyrrolidine-2-carboxylate Openeye Name: methyl 1-[1-(2,5-dimethylpyrazole-3-carbonyl)-4-[(1-methylimidazol-4-yl)sulfonylamino]piperidine-2-carbonyl]pyrrolidine-2-carboxylate CAS Name: 1-[[1-[(2,5-dimethyl-3-pyrazolyl)-oxomethyl]-4-[(1-methyl-4-imidazolyl)sulfonylamino]-2-piperidinyl]-oxomethyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[1-(2,5-dimethylpyrazole-3-carbonyl)-4-[(1-methylimidazol-4-yl)sulfonylamino]piperidine-2-carbonyl]pyrrolidine-2-carboxylate Traditional Name: 1-[1-(2,5-dimethylpyrazole-3-carbonyl)-4-[(1-methylimidazol-4-yl)sulfonylamino]pipecoloyl]pyrrolidine-2-carboxylic acid methyl ester Formula: C22H31N7O6S MolecularWeight: 521.58984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)N2CCC(CC2C(=O)N3CCCC3C(=O)OC)NS(=O)(=O)C4=CN(C=N4)C)C

Isomeric SMILES

CC1=NN(C(=C1)C(=O)N2CCC(CC2C(=O)N3CCCC3C(=O)OC)NS(=O)(=O)C4=CN(C=N4)C)C

InChI

InChI=1S/C22H31N7O6S/c1-14-10-17(27(3)24-14)20(30)29-9-7-15(25-36(33,34)19-12-26(2)13-23-19)11-18(29)21(31)28-8-5-6-16(28)22(32)35-4/h10,12-13,15-16,18,25H,5-9,11H2,1-4H3