ethyl 2-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)sulfonylamino]-6-[(4-methylphenyl)sulfonylamino]hexanoate

Systemtic Name: ethyl 2-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)sulfonylamino]-6-[(4-methylphenyl)sulfonylamino]hexanoate Openeye Name: ethyl 2-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)sulfonylamino]-6-(p-tolylsulfonylamino)hexanoate CAS Name: 2-[(5-chloro-1,3-dimethyl-4-pyrazolyl)sulfonylamino]-6-[(4-methylphenyl)sulfonylamino]hexanoic acid ethyl ester IUPAC Name: ethyl 2-[(5-chloro-1,3-dimethylpyrazol-4-yl)sulfonylamino]-6-[(4-methylphenyl)sulfonylamino]hexanoate Traditional Name: 2-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)sulfonylamino]-6-(tosylamino)hexanoic acid ethyl ester Formula: C20H29ClN4O6S2 MolecularWeight: 521.05046

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCNS(=O)(=O)C1=CC=C(C=C1)C)NS(=O)(=O)C2=C(N(N=C2C)C)Cl

Isomeric SMILES

CCOC(=O)C(CCCCNS(=O)(=O)C1=CC=C(C=C1)C)NS(=O)(=O)C2=C(N(N=C2C)C)Cl

InChI

InChI=1S/C20H29ClN4O6S2/c1-5-31-20(26)17(24-33(29,30)18-15(3)23-25(4)19(18)21)8-6-7-13-22-32(27,28)16-11-9-14(2)10-12-16/h9-12,17,22,24H,5-8,13H2,1-4H3