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

Systemtic Name: 4-[(2E)-2-[[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]methylidene]hydrazinyl]-3-nitro-benzenesulfonamide Openeye Name: 4-[(2E)-2-[(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)methylene]hydrazino]-3-nitro-benzenesulfonamide CAS Name: 4-[(2E)-2-[[5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]methylidene]hydrazinyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-[(2E)-2-[(1-benzyl-5-chloro-3-methylpyrazol-4-yl)methylidene]hydrazinyl]-3-nitrobenzenesulfonamide Traditional Name: 4-[(N'E)-N'-[(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)methylene]hydrazino]-3-nitro-benzenesulfonamide Formula: C18H17ClN6O4S MolecularWeight: 448.88338

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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-])Cl)CC3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1/C=N/NC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])Cl)CC3=CC=CC=C3

InChI

InChI=1S/C18H17ClN6O4S/c1-12-15(18(19)24(23-12)11-13-5-3-2-4-6-13)10-21-22-16-8-7-14(30(20,28)29)9-17(16)25(26)27/h2-10,22H,11H2,1H3,(H2,20,28,29)/b21-10+