2-[(4-chloranyl-3-nitro-phenyl)sulfonyl-propyl-amino]-N-(2,5-ditert-butylpyrazol-3-yl)ethanamide

Systemtic Name: 2-[(4-chloranyl-3-nitro-phenyl)sulfonyl-propyl-amino]-N-(2,5-ditert-butylpyrazol-3-yl)ethanamide Openeye Name: 2-[(4-chloro-3-nitro-phenyl)sulfonyl-propyl-amino]-N-(2,5-ditert-butylpyrazol-3-yl)acetamide CAS Name: 2-[(4-chloro-3-nitrophenyl)sulfonyl-propylamino]-N-(2,5-ditert-butyl-3-pyrazolyl)acetamide IUPAC Name: 2-[(4-chloro-3-nitrophenyl)sulfonyl-propylamino]-N-(2,5-ditert-butylpyrazol-3-yl)acetamide Traditional Name: 2-[(4-chloro-3-nitro-phenyl)sulfonyl-propyl-amino]-N-(2,5-ditert-butylpyrazol-3-yl)acetamide Formula: C22H32ClN5O5S MolecularWeight: 514.03798

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)NC1=CC(=NN1C(C)(C)C)C(C)(C)C)S(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCN(CC(=O)NC1=CC(=NN1C(C)(C)C)C(C)(C)C)S(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H32ClN5O5S/c1-8-11-26(34(32,33)15-9-10-16(23)17(12-15)28(30)31)14-20(29)24-19-13-18(21(2,3)4)25-27(19)22(5,6)7/h9-10,12-13H,8,11,14H2,1-7H3,(H,24,29)