2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]ethanamide

Systemtic Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]ethanamide Openeye Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[4-[(3,5-dimethyl-1-piperidyl)sulfonyl]phenyl]acetamide CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-N-[4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]phenyl]acetamide IUPAC Name: 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]acetamide Traditional Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[4-(3,5-dimethylpiperidino)sulfonylphenyl]acetamide Formula: C20H27N5O5S MolecularWeight: 449.52388

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CN3C(=C(C(=N3)C)[N+](=O)[O-])C)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CN3C(=C(C(=N3)C)[N+](=O)[O-])C)C

InChI

InChI=1S/C20H27N5O5S/c1-13-9-14(2)11-23(10-13)31(29,30)18-7-5-17(6-8-18)21-19(26)12-24-16(4)20(25(27)28)15(3)22-24/h5-8,13-14H,9-12H2,1-4H3,(H,21,26)