(4E)-4-[[4-(2-methoxyethoxy)-5-sulfonyl-cyclohexa-1,3-dien-1-yl]hydrazinylidene]-5-oxidanylidene-1-phenyl-pyrazole-3-carbonitrile

Systemtic Name: (4E)-4-[[4-(2-methoxyethoxy)-5-sulfonyl-cyclohexa-1,3-dien-1-yl]hydrazinylidene]-5-oxidanylidene-1-phenyl-pyrazole-3-carbonitrile Openeye Name: (4E)-4-[[4-(2-methoxyethoxy)-5-sulfonyl-cyclohexa-1,3-dien-1-yl]hydrazono]-5-oxo-1-phenyl-pyrazole-3-carbonitrile CAS Name: (4E)-4-[[4-(2-methoxyethoxy)-5-sulfonyl-1-cyclohexa-1,3-dienyl]hydrazinylidene]-5-oxo-1-phenyl-3-pyrazolecarbonitrile IUPAC Name: (4E)-4-[[4-(2-methoxyethoxy)-5-sulfonylcyclohexa-1,3-dien-1-yl]hydrazinylidene]-5-oxo-1-phenylpyrazole-3-carbonitrile Traditional Name: (4E)-5-keto-4-[[4-(2-methoxyethoxy)-5-sulfonyl-cyclohexa-1,3-dien-1-yl]hydrazono]-1-phenyl-2-pyrazoline-3-carbonitrile Formula: C19H17N5O5S MolecularWeight: 427.43378

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=CC=C(CC1=S(=O)=O)NN=C2C(=NN(C2=O)C3=CC=CC=C3)C#N

Isomeric SMILES

COCCOC1=CC=C(CC1=S(=O)=O)N/N=C/2\C(=NN(C2=O)C3=CC=CC=C3)C#N

InChI

InChI=1S/C19H17N5O5S/c1-28-9-10-29-16-8-7-13(11-17(16)30(26)27)21-22-18-15(12-20)23-24(19(18)25)14-5-3-2-4-6-14/h2-8,21H,9-11H2,1H3/b22-18+