1-ethyl-3,5-dimethyl-N-[3-(3-nitropyrazol-1-yl)propyl]pyrazole-4-sulfonamide

Systemtic Name: 1-ethyl-3,5-dimethyl-N-[3-(3-nitropyrazol-1-yl)propyl]pyrazole-4-sulfonamide Openeye Name: 1-ethyl-3,5-dimethyl-N-[3-(3-nitropyrazol-1-yl)propyl]pyrazole-4-sulfonamide CAS Name: 1-ethyl-3,5-dimethyl-N-[3-(3-nitro-1-pyrazolyl)propyl]-4-pyrazolesulfonamide IUPAC Name: 1-ethyl-3,5-dimethyl-N-[3-(3-nitropyrazol-1-yl)propyl]pyrazole-4-sulfonamide Traditional Name: 1-ethyl-3,5-dimethyl-N-[3-(3-nitropyrazol-1-yl)propyl]pyrazole-4-sulfonamide Formula: C13H20N6O4S MolecularWeight: 356.4007

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)S(=O)(=O)NCCCN2C=CC(=N2)[N+](=O)[O-])C

Isomeric SMILES

CCN1C(=C(C(=N1)C)S(=O)(=O)NCCCN2C=CC(=N2)[N+](=O)[O-])C

InChI

InChI=1S/C13H20N6O4S/c1-4-18-11(3)13(10(2)15-18)24(22,23)14-7-5-8-17-9-6-12(16-17)19(20)21/h6,9,14H,4-5,7-8H2,1-3H3