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

Systemtic Name: (4Z)-2-(4-nitrophenyl)-4-[1-[(2-phenylsulfanylphenyl)amino]ethylidene]-5-propyl-pyrazol-3-one Openeye Name: (4Z)-2-(4-nitrophenyl)-4-[1-(2-phenylsulfanylanilino)ethylidene]-5-propyl-pyrazol-3-one CAS Name: (4Z)-2-(4-nitrophenyl)-4-[1-[2-(phenylthio)anilino]ethylidene]-5-propyl-3-pyrazolone IUPAC Name: (4Z)-2-(4-nitrophenyl)-4-[1-(2-phenylsulfanylanilino)ethylidene]-5-propylpyrazol-3-one Traditional Name: (4Z)-2-(4-nitrophenyl)-4-[1-[2-(phenylthio)anilino]ethylidene]-5-propyl-2-pyrazolin-3-one Formula: C26H24N4O3S MolecularWeight: 472.55876

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=C(C)NC2=CC=CC=C2SC3=CC=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCCC\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/C26H24N4O3S/c1-3-9-23-25(26(31)29(28-23)19-14-16-20(17-15-19)30(32)33)18(2)27-22-12-7-8-13-24(22)34-21-10-5-4-6-11-21/h4-8,10-17,27H,3,9H2,1-2H3/b25-18-