4-[[[(1E)-1-[1-(4-methoxyphenyl)-5-oxidanylidene-3-propyl-pyrazol-4-ylidene]ethyl]amino]methyl]benzenesulfonamide

Systemtic Name: 4-[[[(1E)-1-[1-(4-methoxyphenyl)-5-oxidanylidene-3-propyl-pyrazol-4-ylidene]ethyl]amino]methyl]benzenesulfonamide Openeye Name: 4-[[[(1E)-1-[1-(4-methoxyphenyl)-5-oxo-3-propyl-pyrazol-4-ylidene]ethyl]amino]methyl]benzenesulfonamide CAS Name: 4-[[[(1E)-1-[1-(4-methoxyphenyl)-5-oxo-3-propyl-4-pyrazolylidene]ethyl]amino]methyl]benzenesulfonamide IUPAC Name: 4-[[[(1E)-1-[1-(4-methoxyphenyl)-5-oxo-3-propylpyrazol-4-ylidene]ethyl]amino]methyl]benzenesulfonamide Traditional Name: 4-[[[(1E)-1-[5-keto-1-(4-methoxyphenyl)-3-propyl-2-pyrazolin-4-ylidene]ethyl]amino]methyl]benzenesulfonamide Formula: C22H26N4O4S MolecularWeight: 442.53124

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=C(C)NCC2=CC=C(C=C2)S(=O)(=O)N)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCC\1=NN(C(=O)/C1=C(\C)/NCC2=CC=C(C=C2)S(=O)(=O)N)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H26N4O4S/c1-4-5-20-21(22(27)26(25-20)17-8-10-18(30-3)11-9-17)15(2)24-14-16-6-12-19(13-7-16)31(23,28)29/h6-13,24H,4-5,14H2,1-3H3,(H2,23,28,29)/b21-15+