[2-[3-(4-dimethylaminophenyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydropyrazol-5-yl]phenyl] ethanoate

Systemtic Name: [2-[3-(4-dimethylaminophenyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydropyrazol-5-yl]phenyl] ethanoate Openeye Name: [2-[3-(4-dimethylaminophenyl)-2-(p-tolylsulfonyl)-3,4-dihydropyrazol-5-yl]phenyl] acetate CAS Name: acetic acid [2-[3-(4-dimethylaminophenyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydropyrazol-5-yl]phenyl] ester IUPAC Name: [2-[3-(4-dimethylaminophenyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydropyrazol-5-yl]phenyl] acetate Traditional Name: acetic acid [2-[5-(4-dimethylaminophenyl)-1-tosyl-2-pyrazolin-3-yl]phenyl] ester Formula: C26H27N3O4S MolecularWeight: 477.57528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(CC(=N2)C3=CC=CC=C3OC(=O)C)C4=CC=C(C=C4)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(CC(=N2)C3=CC=CC=C3OC(=O)C)C4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C26H27N3O4S/c1-18-9-15-22(16-10-18)34(31,32)29-25(20-11-13-21(14-12-20)28(3)4)17-24(27-29)23-7-5-6-8-26(23)33-19(2)30/h5-16,25H,17H2,1-4H3