methyl 2-[(4Z)-5-oxidanylidene-1-phenyl-4-[1-[(2-phenylsulfanylphenyl)amino]ethylidene]pyrazol-3-yl]ethanoate

Systemtic Name: methyl 2-[(4Z)-5-oxidanylidene-1-phenyl-4-[1-[(2-phenylsulfanylphenyl)amino]ethylidene]pyrazol-3-yl]ethanoate Openeye Name: methyl 2-[(4Z)-5-oxo-1-phenyl-4-[1-(2-phenylsulfanylanilino)ethylidene]pyrazol-3-yl]acetate CAS Name: 2-[(4Z)-5-oxo-1-phenyl-4-[1-[2-(phenylthio)anilino]ethylidene]-3-pyrazolyl]acetic acid methyl ester IUPAC Name: methyl 2-[(4Z)-5-oxo-1-phenyl-4-[1-(2-phenylsulfanylanilino)ethylidene]pyrazol-3-yl]acetate Traditional Name: 2-[(4Z)-5-keto-1-phenyl-4-[1-[2-(phenylthio)anilino]ethylidene]-2-pyrazolin-3-yl]acetic acid methyl ester Formula: C26H23N3O3S MolecularWeight: 457.54412

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C(=NN(C1=O)C2=CC=CC=C2)CC(=O)OC)NC3=CC=CC=C3SC4=CC=CC=C4

Isomeric SMILES

C/C(=C/1\C(=NN(C1=O)C2=CC=CC=C2)CC(=O)OC)/NC3=CC=CC=C3SC4=CC=CC=C4

InChI

InChI=1S/C26H23N3O3S/c1-18(27-21-15-9-10-16-23(21)33-20-13-7-4-8-14-20)25-22(17-24(30)32-2)28-29(26(25)31)19-11-5-3-6-12-19/h3-16,27H,17H2,1-2H3/b25-18-