(3,4-dimethyl-1,2-oxazol-5-yl)-[4-[[5-(4-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazol-3-yl]carbonylamino]phenyl]sulfonyl-azanide

Systemtic Name: (3,4-dimethyl-1,2-oxazol-5-yl)-[4-[[5-(4-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazol-3-yl]carbonylamino]phenyl]sulfonyl-azanide Openeye Name: (3,4-dimethylisoxazol-5-yl)-[4-[[5-(4-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carbonyl]amino]phenyl]sulfonyl-azanide CAS Name: (3,4-dimethyl-5-isoxazolyl)-[4-[[[5-(4-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)-1,2-dihydropyrazol-3-yl]-oxomethyl]amino]phenyl]sulfonylazanide IUPAC Name: (3,4-dimethyl-1,2-oxazol-5-yl)-[4-[[5-(4-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carbonyl]amino]phenyl]sulfonylazanide Traditional Name: (3,4-dimethylisoxazol-5-yl)-[4-[[5-(6-keto-4-methyl-cyclohexa-2,4-dien-1-ylidene)-3-pyrazoline-3-carbonyl]amino]phenyl]sulfonyl-azanide Formula: C22H20N5O5S- MolecularWeight: 466.4897

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C2C=C(NN2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)[N-]C4=C(C(=NO4)C)C)C=C1

Isomeric SMILES

CC1=CC(=O)C(=C2C=C(NN2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)[N-]C4=C(C(=NO4)C)C)C=C1

InChI

InChI=1S/C22H21N5O5S/c1-12-4-9-17(20(28)10-12)18-11-19(25-24-18)21(29)23-15-5-7-16(8-6-15)33(30,31)27-22-13(2)14(3)26-32-22/h4-11H,1-3H3,(H4,23,24,25,26,27,28,29)/p-1