4-[(2E)-2-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methylidene]hydrazinyl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-[(2E)-2-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methylidene]hydrazinyl]-3-nitro-benzenesulfonamide Openeye Name: 4-[(2E)-2-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methylene]hydrazino]-3-nitro-benzenesulfonamide CAS Name: 4-[(2E)-2-[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methylidene]hydrazinyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-[(2E)-2-[(1-benzyl-3,5-dimethylpyrazol-4-yl)methylidene]hydrazinyl]-3-nitrobenzenesulfonamide Traditional Name: 4-[(N'E)-N'-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methylene]hydrazino]-3-nitro-benzenesulfonamide Formula: C19H20N6O4S MolecularWeight: 428.4649

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)C=NNC3=C(C=C(C=C3)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)/C=N/NC3=C(C=C(C=C3)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C19H20N6O4S/c1-13-17(14(2)24(23-13)12-15-6-4-3-5-7-15)11-21-22-18-9-8-16(30(20,28)29)10-19(18)25(26)27/h3-11,22H,12H2,1-2H3,(H2,20,28,29)/b21-11+