4-[(2E)-2-[(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methylidene]hydrazinyl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-[(2E)-2-[(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methylidene]hydrazinyl]-3-nitro-benzenesulfonamide Openeye Name: 4-[(2E)-2-[(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methylene]hydrazino]-3-nitro-benzenesulfonamide CAS Name: 4-[(2E)-2-[[3-methyl-1-phenyl-5-(1-pyrrolidinyl)-4-pyrazolyl]methylidene]hydrazinyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-[(2E)-2-[(3-methyl-1-phenyl-5-pyrrolidin-1-ylpyrazol-4-yl)methylidene]hydrazinyl]-3-nitrobenzenesulfonamide Traditional Name: 4-[(N'E)-N'-[(3-methyl-1-phenyl-5-pyrrolidino-pyrazol-4-yl)methylene]hydrazino]-3-nitro-benzenesulfonamide Formula: C21H23N7O4S MolecularWeight: 469.51682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NNC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])N3CCCC3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1/C=N/NC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])N3CCCC3)C4=CC=CC=C4

InChI

InChI=1S/C21H23N7O4S/c1-15-18(14-23-24-19-10-9-17(33(22,31)32)13-20(19)28(29)30)21(26-11-5-6-12-26)27(25-15)16-7-3-2-4-8-16/h2-4,7-10,13-14,24H,5-6,11-12H2,1H3,(H2,22,31,32)/b23-14+