1-[2,4-bis(chloranyl)-3-[(2,4-dimethylquinolin-8-yl)oxymethyl]phenyl]sulfonyl-N-[3-[(4-cyanophenyl)carbonylamino]propyl]-N-methyl-pyrrolidine-2-carboxamide

Systemtic Name: 1-[2,4-bis(chloranyl)-3-[(2,4-dimethylquinolin-8-yl)oxymethyl]phenyl]sulfonyl-N-[3-[(4-cyanophenyl)carbonylamino]propyl]-N-methyl-pyrrolidine-2-carboxamide Openeye Name: N-[3-[(4-cyanobenzoyl)amino]propyl]-1-[2,4-dichloro-3-[(2,4-dimethyl-8-quinolyl)oxymethyl]phenyl]sulfonyl-N-methyl-pyrrolidine-2-carboxamide CAS Name: N-[3-[[(4-cyanophenyl)-oxomethyl]amino]propyl]-1-[2,4-dichloro-3-[(2,4-dimethyl-8-quinolinyl)oxymethyl]phenyl]sulfonyl-N-methyl-2-pyrrolidinecarboxamide IUPAC Name: N-[3-[(4-cyanobenzoyl)amino]propyl]-1-[2,4-dichloro-3-[(2,4-dimethylquinolin-8-yl)oxymethyl]phenyl]sulfonyl-N-methylpyrrolidine-2-carboxamide Traditional Name: N-[3-[(4-cyanobenzoyl)amino]propyl]-1-[2,4-dichloro-3-[(2,4-dimethyl-8-quinolyl)oxymethyl]phenyl]sulfonyl-N-methyl-pyrrolidine-2-carboxamide Formula: C35H35Cl2N5O5S MolecularWeight: 708.6539

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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)N(C)CCCNC(=O)C5=CC=C(C=C5)C#N)Cl)C

Isomeric SMILES

CC1=CC(=NC2=C1C=CC=C2OCC3=C(C=CC(=C3Cl)S(=O)(=O)N4CCCC4C(=O)N(C)CCCNC(=O)C5=CC=C(C=C5)C#N)Cl)C

InChI

InChI=1S/C35H35Cl2N5O5S/c1-22-19-23(2)40-33-26(22)7-4-9-30(33)47-21-27-28(36)14-15-31(32(27)37)48(45,46)42-18-5-8-29(42)35(44)41(3)17-6-16-39-34(43)25-12-10-24(20-38)11-13-25/h4,7,9-15,19,29H,5-6,8,16-18,21H2,1-3H3,(H,39,43)