tert-butyl N-[4-[4-[[1-[2,4-bis(chloranyl)-3-[(2-methylquinolin-8-yl)oxymethyl]phenyl]sulfonylpyrrolidin-2-yl]carbonylamino]piperidin-1-yl]-4-oxidanylidene-butyl]carbamate

Systemtic Name: tert-butyl N-[4-[4-[[1-[2,4-bis(chloranyl)-3-[(2-methylquinolin-8-yl)oxymethyl]phenyl]sulfonylpyrrolidin-2-yl]carbonylamino]piperidin-1-yl]-4-oxidanylidene-butyl]carbamate Openeye Name: tert-butyl N-[4-[4-[[1-[2,4-dichloro-3-[(2-methyl-8-quinolyl)oxymethyl]phenyl]sulfonylpyrrolidine-2-carbonyl]amino]-1-piperidyl]-4-oxo-butyl]carbamate CAS Name: N-[4-[4-[[[1-[2,4-dichloro-3-[(2-methyl-8-quinolinyl)oxymethyl]phenyl]sulfonyl-2-pyrrolidinyl]-oxomethyl]amino]-1-piperidinyl]-4-oxobutyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[4-[[1-[2,4-dichloro-3-[(2-methylquinolin-8-yl)oxymethyl]phenyl]sulfonylpyrrolidine-2-carbonyl]amino]piperidin-1-yl]-4-oxobutyl]carbamate Traditional Name: N-[4-[4-[[1-[2,4-dichloro-3-[(2-methyl-8-quinolyl)oxymethyl]phenyl]sulfonylprolyl]amino]piperidino]-4-keto-butyl]carbamic acid tert-butyl ester Formula: C36H45Cl2N5O7S MolecularWeight: 762.7428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OCC3=C(C=CC(=C3Cl)S(=O)(=O)N4CCCC4C(=O)NC5CCN(CC5)C(=O)CCCNC(=O)OC(C)(C)C)Cl)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2OCC3=C(C=CC(=C3Cl)S(=O)(=O)N4CCCC4C(=O)NC5CCN(CC5)C(=O)CCCNC(=O)OC(C)(C)C)Cl)C=C1

InChI

InChI=1S/C36H45Cl2N5O7S/c1-23-12-13-24-8-5-10-29(33(24)40-23)49-22-26-27(37)14-15-30(32(26)38)51(47,48)43-19-7-9-28(43)34(45)41-25-16-20-42(21-17-25)31(44)11-6-18-39-35(46)50-36(2,3)4/h5,8,10,12-15,25,28H,6-7,9,11,16-22H2,1-4H3,(H,39,46)(H,41,45)