[4-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)iminomethyl]-2-methoxy-phenyl] N-(4-methylphenyl)sulfonylcarbamate

Systemtic Name: [4-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)iminomethyl]-2-methoxy-phenyl] N-(4-methylphenyl)sulfonylcarbamate Openeye Name: [4-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)iminomethyl]-2-methoxy-phenyl] N-(p-tolylsulfonyl)carbamate CAS Name: N-(4-methylphenyl)sulfonylcarbamic acid [4-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)iminomethyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)iminomethyl]-2-methoxyphenyl] N-(4-methylphenyl)sulfonylcarbamate Traditional Name: N-tosylcarbamic acid [4-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)iminomethyl]-2-methoxy-phenyl] ester Formula: C27H26N4O6S MolecularWeight: 534.58354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)OC2=C(C=C(C=C2)C=NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)OC2=C(C=C(C=C2)C=NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C)OC

InChI

InChI=1S/C27H26N4O6S/c1-18-10-13-22(14-11-18)38(34,35)29-27(33)37-23-15-12-20(16-24(23)36-4)17-28-25-19(2)30(3)31(26(25)32)21-8-6-5-7-9-21/h5-17H,1-4H3,(H,29,33)