N-[(1,5-dimethylpyrazol-4-yl)methyl]-N-methyl-1-(4-nitrophenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(1,5-dimethylpyrazol-4-yl)methyl]-N-methyl-1-(4-nitrophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[(1,5-dimethylpyrazol-4-yl)methyl]-N-methyl-1-(4-nitrophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[(1,5-dimethyl-4-pyrazolyl)methyl]-N-methyl-1-(4-nitrophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(1,5-dimethylpyrazol-4-yl)methyl]-N-methyl-1-(4-nitrophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[(1,5-dimethylpyrazol-4-yl)methyl]-N-methyl-1-nosyl-isonipecotamide Formula: C19H25N5O5S MolecularWeight: 435.4973

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)CN(C)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=NN1C)CN(C)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H25N5O5S/c1-14-16(12-20-22(14)3)13-21(2)19(25)15-8-10-23(11-9-15)30(28,29)18-6-4-17(5-7-18)24(26)27/h4-7,12,15H,8-11,13H2,1-3H3