4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[2-[(4-methoxyphenyl)sulfonylamino]ethyl]benzamide

Systemtic Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[2-[(4-methoxyphenyl)sulfonylamino]ethyl]benzamide Openeye Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[2-[(4-methoxyphenyl)sulfonylamino]ethyl]benzamide CAS Name: 4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-[2-[(4-methoxyphenyl)sulfonylamino]ethyl]benzamide IUPAC Name: 4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-N-[2-[(4-methoxyphenyl)sulfonylamino]ethyl]benzamide Traditional Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[2-[(4-methoxyphenyl)sulfonylamino]ethyl]benzamide Formula: C22H25N5O6S MolecularWeight: 487.5288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NCCNS(=O)(=O)C3=CC=C(C=C3)OC)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NCCNS(=O)(=O)C3=CC=C(C=C3)OC)C)[N+](=O)[O-]

InChI

InChI=1S/C22H25N5O6S/c1-15-21(27(29)30)16(2)26(25-15)14-17-4-6-18(7-5-17)22(28)23-12-13-24-34(31,32)20-10-8-19(33-3)9-11-20/h4-11,24H,12-14H2,1-3H3,(H,23,28)