4-[4-[1-[2,4-bis(chloranyl)-3-[(2,4-dimethylquinolin-8-yl)oxymethyl]phenyl]sulfonylpyrrolidin-2-yl]carbonylpiperazin-1-yl]carbonylbenzenecarboximidamide dihydrochloride

Systemtic Name: 4-[4-[1-[2,4-bis(chloranyl)-3-[(2,4-dimethylquinolin-8-yl)oxymethyl]phenyl]sulfonylpyrrolidin-2-yl]carbonylpiperazin-1-yl]carbonylbenzenecarboximidamide dihydrochloride Openeye Name: 4-[4-[1-[2,4-dichloro-3-[(2,4-dimethyl-8-quinolyl)oxymethyl]phenyl]sulfonylpyrrolidine-2-carbonyl]piperazine-1-carbonyl]benzamidine dihydrochloride CAS Name: 4-[[4-[[1-[2,4-dichloro-3-[(2,4-dimethyl-8-quinolinyl)oxymethyl]phenyl]sulfonyl-2-pyrrolidinyl]-oxomethyl]-1-piperazinyl]-oxomethyl]benzenecarboximidamide dihydrochloride IUPAC Name: 4-[4-[1-[2,4-dichloro-3-[(2,4-dimethylquinolin-8-yl)oxymethyl]phenyl]sulfonylpyrrolidine-2-carbonyl]piperazine-1-carbonyl]benzenecarboximidamide dihydrochloride Traditional Name: 4-[4-[1-[2,4-dichloro-3-[(2,4-dimethyl-8-quinolyl)oxymethyl]phenyl]sulfonylprolyl]piperazine-1-carbonyl]benzamidine dihydrochloride Formula: C35H38Cl4N6O5S MolecularWeight: 796.59042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=CC=C2OCC3=C(C=CC(=C3Cl)S(=O)(=O)N4CCCC4C(=O)N5CCN(CC5)C(=O)C6=CC=C(C=C6)C(=N)N)Cl)C.Cl.Cl

Isomeric SMILES

CC1=CC(=NC2=C1C=CC=C2OCC3=C(C=CC(=C3Cl)S(=O)(=O)N4CCCC4C(=O)N5CCN(CC5)C(=O)C6=CC=C(C=C6)C(=N)N)Cl)C.Cl.Cl

InChI

InChI=1S/C35H36Cl2N6O5S.2ClH/c1-21-19-22(2)40-32-25(21)5-3-7-29(32)48-20-26-27(36)12-13-30(31(26)37)49(46,47)43-14-4-6-28(43)35(45)42-17-15-41(16-18-42)34(44)24-10-8-23(9-11-24)33(38)39;;/h3,5,7-13,19,28H,4,6,14-18,20H2,1-2H3,(H3,38,39);2*1H