(4Z)-4-[1-[2-(4-methylphenyl)sulfanylethylamino]ethylidene]-2,5-diphenyl-pyrazol-3-one

Systemtic Name: (4Z)-4-[1-[2-(4-methylphenyl)sulfanylethylamino]ethylidene]-2,5-diphenyl-pyrazol-3-one Openeye Name: (4Z)-2,5-diphenyl-4-[1-[2-(p-tolylsulfanyl)ethylamino]ethylidene]pyrazol-3-one CAS Name: (4Z)-4-[1-[2-[(4-methylphenyl)thio]ethylamino]ethylidene]-2,5-diphenyl-3-pyrazolone IUPAC Name: (4Z)-4-[1-[2-(4-methylphenyl)sulfanylethylamino]ethylidene]-2,5-diphenylpyrazol-3-one Traditional Name: (4Z)-2,5-diphenyl-4-[1-[2-(p-tolylthio)ethylamino]ethylidene]-2-pyrazolin-3-one Formula: C26H25N3OS MolecularWeight: 427.5612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=C2C(=NN(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)SCCN/C(=C\2/C(=NN(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)/C

InChI

InChI=1S/C26H25N3OS/c1-19-13-15-23(16-14-19)31-18-17-27-20(2)24-25(21-9-5-3-6-10-21)28-29(26(24)30)22-11-7-4-8-12-22/h3-16,27H,17-18H2,1-2H3/b24-20-