[4-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)iminomethyl]-2-methoxy-phenyl] 2-prop-2-enylsulfanylethanoate

Systemtic Name: [4-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)iminomethyl]-2-methoxy-phenyl] 2-prop-2-enylsulfanylethanoate Openeye Name: [4-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)iminomethyl]-2-methoxy-phenyl] 2-allylsulfanylacetate CAS Name: 2-(prop-2-enylthio)acetic 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] 2-prop-2-enylsulfanylacetate Traditional Name: 2-(allylthio)acetic acid [4-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)iminomethyl]-2-methoxy-phenyl] ester Formula: C24H25N3O4S MolecularWeight: 451.538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=CC(=C(C=C3)OC(=O)CSCC=C)OC

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=CC(=C(C=C3)OC(=O)CSCC=C)OC

InChI

InChI=1S/C24H25N3O4S/c1-5-13-32-16-22(28)31-20-12-11-18(14-21(20)30-4)15-25-23-17(2)26(3)27(24(23)29)19-9-7-6-8-10-19/h5-12,14-15H,1,13,16H2,2-4H3