N-[1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]pyrazol-4-yl]-4-nitro-benzenesulfonamide hydrochloride

Systemtic Name: N-[1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]pyrazol-4-yl]-4-nitro-benzenesulfonamide hydrochloride Openeye Name: N-[1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]pyrazol-4-yl]-4-nitro-benzenesulfonamide hydrochloride CAS Name: N-[1-[(1-ethyl-5-methyl-4-pyrazolyl)methyl]-4-pyrazolyl]-4-nitrobenzenesulfonamide hydrochloride IUPAC Name: N-[1-[(1-ethyl-5-methylpyrazol-4-yl)methyl]pyrazol-4-yl]-4-nitrobenzenesulfonamide hydrochloride Traditional Name: N-[1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]pyrazol-4-yl]-4-nitro-benzenesulfonamide hydrochloride Formula: C16H19ClN6O4S MolecularWeight: 426.87786

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)CN2C=C(C=N2)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C.Cl

Isomeric SMILES

CCN1C(=C(C=N1)CN2C=C(C=N2)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C.Cl

InChI

InChI=1S/C16H18N6O4S.ClH/c1-3-21-12(2)13(8-18-21)10-20-11-14(9-17-20)19-27(25,26)16-6-4-15(5-7-16)22(23)24;/h4-9,11,19H,3,10H2,1-2H3;1H