(4E)-3-phenyl-4-(5-phenyl-1,3-oxathiol-2-ylidene)-1H-pyrazol-5-one

Systemtic Name: (4E)-3-phenyl-4-(5-phenyl-1,3-oxathiol-2-ylidene)-1H-pyrazol-5-one Openeye Name: (4E)-3-phenyl-4-(5-phenyl-1,3-oxathiol-2-ylidene)-1H-pyrazol-5-one CAS Name: (4E)-3-phenyl-4-(5-phenyl-1,3-oxathiol-2-ylidene)-1H-pyrazol-5-one IUPAC Name: (4E)-3-phenyl-4-(5-phenyl-1,3-oxathiol-2-ylidene)-1H-pyrazol-5-one Traditional Name: (4E)-5-phenyl-4-(5-phenyl-1,3-oxathiol-2-ylidene)-2-pyrazolin-3-one Formula: C18H12N2O2S MolecularWeight: 320.36508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC(=C3C(=NNC3=O)C4=CC=CC=C4)O2

Isomeric SMILES

C1=CC=C(C=C1)C2=CS/C(=C/3\C(=NNC3=O)C4=CC=CC=C4)/O2

InChI

InChI=1S/C18H12N2O2S/c21-17-15(16(19-20-17)13-9-5-2-6-10-13)18-22-14(11-23-18)12-7-3-1-4-8-12/h1-11H,(H,20,21)/b18-15+