4-methyl-3-nitro-N-[(E)-[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]methylideneamino]benzenesulfonamide

Systemtic Name: 4-methyl-3-nitro-N-[(E)-[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]methylideneamino]benzenesulfonamide Openeye Name: N-[(E)-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]methyleneamino]-4-methyl-3-nitro-benzenesulfonamide CAS Name: 4-methyl-3-nitro-N-[(E)-[1-(phenylmethyl)-3-(3-pyridinyl)-4-pyrazolyl]methylideneamino]benzenesulfonamide IUPAC Name: N-[(E)-(1-benzyl-3-pyridin-3-ylpyrazol-4-yl)methylideneamino]-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N-[(E)-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]methyleneamino]-4-methyl-3-nitro-benzenesulfonamide Formula: C23H20N6O4S MolecularWeight: 476.5077

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NN=CC2=CN(N=C2C3=CN=CC=C3)CC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N/N=C/C2=CN(N=C2C3=CN=CC=C3)CC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H20N6O4S/c1-17-9-10-21(12-22(17)29(30)31)34(32,33)27-25-14-20-16-28(15-18-6-3-2-4-7-18)26-23(20)19-8-5-11-24-13-19/h2-14,16,27H,15H2,1H3/b25-14+