N-methyl-4-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-3-nitro-benzenesulfonamide

Systemtic Name: N-methyl-4-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-3-nitro-benzenesulfonamide Openeye Name: N-methyl-4-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-3-nitro-benzenesulfonamide CAS Name: N-methyl-4-[methyl-[(1-methyl-4-pyrazolyl)methyl]amino]-3-nitrobenzenesulfonamide IUPAC Name: N-methyl-4-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-3-nitrobenzenesulfonamide Traditional Name: N-methyl-4-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-3-nitro-benzenesulfonamide Formula: C13H17N5O4S MolecularWeight: 339.37018

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C=C1)N(C)CC2=CN(N=C2)C)[N+](=O)[O-]

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C=C1)N(C)CC2=CN(N=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C13H17N5O4S/c1-14-23(21,22)11-4-5-12(13(6-11)18(19)20)16(2)8-10-7-15-17(3)9-10/h4-7,9,14H,8H2,1-3H3