(4Z)-5-methyl-2-(4-nitrophenyl)-4-[1-[(2-phenylsulfanylphenyl)amino]ethylidene]pyrazol-3-one

Systemtic Name: (4Z)-5-methyl-2-(4-nitrophenyl)-4-[1-[(2-phenylsulfanylphenyl)amino]ethylidene]pyrazol-3-one Openeye Name: (4Z)-5-methyl-2-(4-nitrophenyl)-4-[1-(2-phenylsulfanylanilino)ethylidene]pyrazol-3-one CAS Name: (4Z)-5-methyl-2-(4-nitrophenyl)-4-[1-[2-(phenylthio)anilino]ethylidene]-3-pyrazolone IUPAC Name: (4Z)-5-methyl-2-(4-nitrophenyl)-4-[1-(2-phenylsulfanylanilino)ethylidene]pyrazol-3-one Traditional Name: (4Z)-5-methyl-2-(4-nitrophenyl)-4-[1-[2-(phenylthio)anilino]ethylidene]-2-pyrazolin-3-one Formula: C24H20N4O3S MolecularWeight: 444.5056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=C(C)NC2=CC=CC=C2SC3=CC=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC\1=NN(C(=O)/C1=C(/C)\NC2=CC=CC=C2SC3=CC=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H20N4O3S/c1-16(25-21-10-6-7-11-22(21)32-20-8-4-3-5-9-20)23-17(2)26-27(24(23)29)18-12-14-19(15-13-18)28(30)31/h3-15,25H,1-2H3/b23-16-