(4E)-5-methyl-4-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethylidene]-2-phenyl-pyrazol-3-one

Systemtic Name: (4E)-5-methyl-4-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethylidene]-2-phenyl-pyrazol-3-one Openeye Name: (4E)-5-methyl-4-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethylene]-2-phenyl-pyrazol-3-one CAS Name: (4E)-5-methyl-4-[[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]methylidene]-2-phenyl-3-pyrazolone IUPAC Name: (4E)-5-methyl-4-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethylidene]-2-phenylpyrazol-3-one Traditional Name: (4E)-5-methyl-4-[[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]methylene]-2-phenyl-2-pyrazolin-3-one Formula: C20H17N5OS MolecularWeight: 375.44688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CSC2=NN=C(N2C3=CC=CC=C3)C)C4=CC=CC=C4

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/SC2=NN=C(N2C3=CC=CC=C3)C)C4=CC=CC=C4

InChI

InChI=1S/C20H17N5OS/c1-14-18(19(26)25(23-14)17-11-7-4-8-12-17)13-27-20-22-21-15(2)24(20)16-9-5-3-6-10-16/h3-13H,1-2H3/b18-13+