(4E)-5-methyl-2-phenyl-4-[[4-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)phenyl]hydrazinylidene]pyrazol-3-one

Systemtic Name: (4E)-5-methyl-2-phenyl-4-[[4-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)phenyl]hydrazinylidene]pyrazol-3-one Openeye Name: (4E)-4-[[4-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)phenyl]hydrazono]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: (4E)-5-methyl-2-phenyl-4-[[4-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)phenyl]hydrazinylidene]-3-pyrazolone IUPAC Name: (4E)-5-methyl-2-phenyl-4-[[4-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)phenyl]hydrazinylidene]pyrazol-3-one Traditional Name: (4E)-4-[[4-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)phenyl]hydrazono]-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C21H19N7OS MolecularWeight: 417.48686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=NNC2=CC=C(C=C2)C3=NNC(=S)N3CC=C)C4=CC=CC=C4

Isomeric SMILES

CC\1=NN(C(=O)/C1=N/NC2=CC=C(C=C2)C3=NNC(=S)N3CC=C)C4=CC=CC=C4

InChI

InChI=1S/C21H19N7OS/c1-3-13-27-19(24-25-21(27)30)15-9-11-16(12-10-15)22-23-18-14(2)26-28(20(18)29)17-7-5-4-6-8-17/h3-12,22H,1,13H2,2H3,(H,25,30)/b23-18+