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

Systemtic Name: (4Z)-5-methyl-2-pyridin-4-ylcarbonyl-4-[(2-sulfanylidene-3H-benzimidazol-1-yl)methylidene]pyrazol-3-one Openeye Name: (4Z)-5-methyl-2-(pyridine-4-carbonyl)-4-[(2-thioxo-3H-benzimidazol-1-yl)methylene]pyrazol-3-one CAS Name: (4Z)-5-methyl-2-[oxo(pyridin-4-yl)methyl]-4-[(2-sulfanylidene-3H-benzimidazol-1-yl)methylidene]-3-pyrazolone IUPAC Name: (4Z)-5-methyl-2-(pyridine-4-carbonyl)-4-[(2-sulfanylidene-3H-benzimidazol-1-yl)methylidene]pyrazol-3-one Traditional Name: (4Z)-2-isonicotinoyl-5-methyl-4-[(2-thioxo-3H-benzimidazol-1-yl)methylene]-2-pyrazolin-3-one Formula: C18H13N5O2S MolecularWeight: 363.39312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC\1=NN(C(=O)/C1=C\N2C3=CC=CC=C3NC2=S)C(=O)C4=CC=NC=C4

InChI

InChI=1S/C18H13N5O2S/c1-11-13(10-22-15-5-3-2-4-14(15)20-18(22)26)17(25)23(21-11)16(24)12-6-8-19-9-7-12/h2-10H,1H3,(H,20,26)/b13-10-