4-[2-[(Z)-[1-(5-chloranyl-2-nitro-phenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]methyl]pyrrol-1-yl]benzenesulfonamide

Systemtic Name: 4-[2-[(Z)-[1-(5-chloranyl-2-nitro-phenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]methyl]pyrrol-1-yl]benzenesulfonamide Openeye Name: 4-[2-[(Z)-[1-(5-chloro-2-nitro-phenyl)-3-methyl-5-oxo-pyrazol-4-ylidene]methyl]pyrrol-1-yl]benzenesulfonamide CAS Name: 4-[2-[(Z)-[1-(5-chloro-2-nitrophenyl)-3-methyl-5-oxo-4-pyrazolylidene]methyl]-1-pyrrolyl]benzenesulfonamide IUPAC Name: 4-[2-[(Z)-[1-(5-chloro-2-nitrophenyl)-3-methyl-5-oxopyrazol-4-ylidene]methyl]pyrrol-1-yl]benzenesulfonamide Traditional Name: 4-[2-[(Z)-[1-(5-chloro-2-nitro-phenyl)-5-keto-3-methyl-2-pyrazolin-4-ylidene]methyl]pyrrol-1-yl]benzenesulfonamide Formula: C21H16ClN5O5S MolecularWeight: 485.90024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC=CN2C3=CC=C(C=C3)S(=O)(=O)N)C4=C(C=CC(=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CC\1=NN(C(=O)/C1=C\C2=CC=CN2C3=CC=C(C=C3)S(=O)(=O)N)C4=C(C=CC(=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H16ClN5O5S/c1-13-18(21(28)26(24-13)20-11-14(22)4-9-19(20)27(29)30)12-16-3-2-10-25(16)15-5-7-17(8-6-15)33(23,31)32/h2-12H,1H3,(H2,23,31,32)/b18-12-