(5-methyl-2-phenyl-4-phenylsulfanyl-pyrazol-3-yl) 2-phenoxypropanoate

Systemtic Name: (5-methyl-2-phenyl-4-phenylsulfanyl-pyrazol-3-yl) 2-phenoxypropanoate Openeye Name: (5-methyl-2-phenyl-4-phenylsulfanyl-pyrazol-3-yl) 2-phenoxypropanoate CAS Name: 2-phenoxypropanoic acid [5-methyl-2-phenyl-4-(phenylthio)-3-pyrazolyl] ester IUPAC Name: (5-methyl-2-phenyl-4-phenylsulfanylpyrazol-3-yl) 2-phenoxypropanoate Traditional Name: 2-phenoxypropionic acid [5-methyl-2-phenyl-4-(phenylthio)pyrazol-3-yl] ester Formula: C25H22N2O3S MolecularWeight: 430.51878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1SC2=CC=CC=C2)OC(=O)C(C)OC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1SC2=CC=CC=C2)OC(=O)C(C)OC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H22N2O3S/c1-18-23(31-22-16-10-5-11-17-22)24(27(26-18)20-12-6-3-7-13-20)30-25(28)19(2)29-21-14-8-4-9-15-21/h3-17,19H,1-2H3