[(Z)-[azanyl-[4-[4-[1-[2,4-bis(chloranyl)-3-[(2,4-dimethylquinolin-8-yl)oxymethyl]phenyl]sulfonylpyrrolidin-2-yl]carbonylpiperazin-1-yl]sulfonylphenyl]methylidene]amino] ethanoate

Systemtic Name: [(Z)-[azanyl-[4-[4-[1-[2,4-bis(chloranyl)-3-[(2,4-dimethylquinolin-8-yl)oxymethyl]phenyl]sulfonylpyrrolidin-2-yl]carbonylpiperazin-1-yl]sulfonylphenyl]methylidene]amino] ethanoate Openeye Name: [(Z)-[amino-[4-[4-[1-[2,4-dichloro-3-[(2,4-dimethyl-8-quinolyl)oxymethyl]phenyl]sulfonylpyrrolidine-2-carbonyl]piperazin-1-yl]sulfonylphenyl]methylene]amino] acetate CAS Name: acetic acid [(Z)-[amino-[4-[[4-[[1-[2,4-dichloro-3-[(2,4-dimethyl-8-quinolinyl)oxymethyl]phenyl]sulfonyl-2-pyrrolidinyl]-oxomethyl]-1-piperazinyl]sulfonyl]phenyl]methylidene]amino] ester IUPAC Name: [(Z)-[amino-[4-[4-[1-[2,4-dichloro-3-[(2,4-dimethylquinolin-8-yl)oxymethyl]phenyl]sulfonylpyrrolidine-2-carbonyl]piperazin-1-yl]sulfonylphenyl]methylidene]amino] acetate Traditional Name: acetic acid [(Z)-[amino-[4-[4-[1-[2,4-dichloro-3-[(2,4-dimethyl-8-quinolyl)oxymethyl]phenyl]sulfonylprolyl]piperazino]sulfonylphenyl]methylene]amino] ester Formula: C36H38Cl2N6O8S2 MolecularWeight: 817.75832

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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)S(=O)(=O)C6=CC=C(C=C6)C(=NOC(=O)C)N)Cl)C

Isomeric SMILES

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

InChI

InChI=1S/C36H38Cl2N6O8S2/c1-22-20-23(2)40-34-27(22)6-4-8-31(34)51-21-28-29(37)13-14-32(33(28)38)54(49,50)44-15-5-7-30(44)36(46)42-16-18-43(19-17-42)53(47,48)26-11-9-25(10-12-26)35(39)41-52-24(3)45/h4,6,8-14,20,30H,5,7,15-19,21H2,1-3H3,(H2,39,41)