(3R)-1-(1,5-dimethylpyrazol-4-yl)sulfonyl-N-[2-(5-methyl-3-nitro-pyrazol-1-yl)ethyl]piperidine-3-carboxamide

Systemtic Name: (3R)-1-(1,5-dimethylpyrazol-4-yl)sulfonyl-N-[2-(5-methyl-3-nitro-pyrazol-1-yl)ethyl]piperidine-3-carboxamide Openeye Name: (3R)-1-(1,5-dimethylpyrazol-4-yl)sulfonyl-N-[2-(5-methyl-3-nitro-pyrazol-1-yl)ethyl]piperidine-3-carboxamide CAS Name: (3R)-1-[(1,5-dimethyl-4-pyrazolyl)sulfonyl]-N-[2-(5-methyl-3-nitro-1-pyrazolyl)ethyl]-3-piperidinecarboxamide IUPAC Name: (3R)-1-(1,5-dimethylpyrazol-4-yl)sulfonyl-N-[2-(5-methyl-3-nitropyrazol-1-yl)ethyl]piperidine-3-carboxamide Traditional Name: (3R)-1-(1,5-dimethylpyrazol-4-yl)sulfonyl-N-[2-(5-methyl-3-nitro-pyrazol-1-yl)ethyl]nipecotamide Formula: C17H25N7O5S MolecularWeight: 439.4893

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCNC(=O)C2CCCN(C2)S(=O)(=O)C3=C(N(N=C3)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1CCNC(=O)[C@@H]2CCCN(C2)S(=O)(=O)C3=C(N(N=C3)C)C)[N+](=O)[O-]

InChI

InChI=1S/C17H25N7O5S/c1-12-9-16(24(26)27)20-23(12)8-6-18-17(25)14-5-4-7-22(11-14)30(28,29)15-10-19-21(3)13(15)2/h9-10,14H,4-8,11H2,1-3H3,(H,18,25)/t14-/m1/s1