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

Systemtic Name: 4-methyl-N-[(E)-(1-methylpyrazol-4-yl)methylideneamino]-3-nitro-benzenesulfonamide Openeye Name: 4-methyl-N-[(E)-(1-methylpyrazol-4-yl)methyleneamino]-3-nitro-benzenesulfonamide CAS Name: 4-methyl-N-[(E)-(1-methyl-4-pyrazolyl)methylideneamino]-3-nitrobenzenesulfonamide IUPAC Name: 4-methyl-N-[(E)-(1-methylpyrazol-4-yl)methylideneamino]-3-nitrobenzenesulfonamide Traditional Name: 4-methyl-N-[(E)-(1-methylpyrazol-4-yl)methyleneamino]-3-nitro-benzenesulfonamide Formula: C12H13N5O4S MolecularWeight: 323.32772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NN=CC2=CN(N=C2)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N/N=C/C2=CN(N=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C12H13N5O4S/c1-9-3-4-11(5-12(9)17(18)19)22(20,21)15-13-6-10-7-14-16(2)8-10/h3-8,15H,1-2H3/b13-6+