4-[(2E)-2-[3-cyano-1-(2-methylphenyl)-5-oxidanylidene-pyrazol-4-ylidene]hydrazinyl]-5-methoxy-2-methyl-benzenesulfonyl chloride

Systemtic Name: 4-[(2E)-2-[3-cyano-1-(2-methylphenyl)-5-oxidanylidene-pyrazol-4-ylidene]hydrazinyl]-5-methoxy-2-methyl-benzenesulfonyl chloride Openeye Name: 4-[(2E)-2-[3-cyano-1-(o-tolyl)-5-oxo-pyrazol-4-ylidene]hydrazino]-5-methoxy-2-methyl-benzenesulfonyl chloride CAS Name: 4-[(2E)-2-[3-cyano-1-(2-methylphenyl)-5-oxo-4-pyrazolylidene]hydrazinyl]-5-methoxy-2-methylbenzenesulfonyl chloride IUPAC Name: 4-[(2E)-2-[3-cyano-1-(2-methylphenyl)-5-oxopyrazol-4-ylidene]hydrazinyl]-5-methoxy-2-methylbenzenesulfonyl chloride Traditional Name: 4-[(N'E)-N'-[3-cyano-5-keto-1-(o-tolyl)-2-pyrazolin-4-ylidene]hydrazino]-5-methoxy-2-methyl-benzenesulfonyl chloride Formula: C19H16ClN5O4S MolecularWeight: 445.87944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C(=NNC3=C(C=C(C(=C3)C)S(=O)(=O)Cl)OC)C(=N2)C#N

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)/C(=N/NC3=C(C=C(C(=C3)C)S(=O)(=O)Cl)OC)/C(=N2)C#N

InChI

InChI=1S/C19H16ClN5O4S/c1-11-6-4-5-7-15(11)25-19(26)18(14(10-21)24-25)23-22-13-8-12(2)17(30(20,27)28)9-16(13)29-3/h4-9,22H,1-3H3/b23-18+