5-methyl-2-phenyl-4-[(2-sulfanylidene-3H-benzimidazol-1-yl)methylidene]pyrazol-3-one

Systemtic Name: 5-methyl-2-phenyl-4-[(2-sulfanylidene-3H-benzimidazol-1-yl)methylidene]pyrazol-3-one Openeye Name: 5-methyl-2-phenyl-4-[(2-thioxo-3H-benzimidazol-1-yl)methylene]pyrazol-3-one CAS Name: 5-methyl-2-phenyl-4-[(2-sulfanylidene-3H-benzimidazol-1-yl)methylidene]-3-pyrazolone IUPAC Name: 5-methyl-2-phenyl-4-[(2-sulfanylidene-3H-benzimidazol-1-yl)methylidene]pyrazol-3-one Traditional Name: 5-methyl-2-phenyl-4-[(2-thioxo-3H-benzimidazol-1-yl)methylene]-2-pyrazolin-3-one Formula: C18H14N4OS MolecularWeight: 334.39496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CN2C3=CC=CC=C3NC2=S)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=O)C1=CN2C3=CC=CC=C3NC2=S)C4=CC=CC=C4

InChI

InChI=1S/C18H14N4OS/c1-12-14(17(23)22(20-12)13-7-3-2-4-8-13)11-21-16-10-6-5-9-15(16)19-18(21)24/h2-11H,1H3,(H,19,24)