1-[[(3-pyridin-3-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]naphthalen-2-one

Systemtic Name: 1-[[(3-pyridin-3-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]naphthalen-2-one Openeye Name: 1-[[[3-(3-pyridyl)-5-thioxo-1H-1,2,4-triazol-4-yl]amino]methylene]naphthalen-2-one CAS Name: 1-[[[3-(3-pyridinyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]amino]methylidene]-2-naphthalenone IUPAC Name: 1-[[(3-pyridin-3-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]naphthalen-2-one Traditional Name: 1-[[[3-(3-pyridyl)-5-thioxo-1H-1,2,4-triazol-4-yl]amino]methylene]naphthalen-2-one Formula: C18H13N5OS MolecularWeight: 347.39372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=O)C2=CNN3C(=NNC3=S)C4=CN=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=O)C2=CNN3C(=NNC3=S)C4=CN=CC=C4

InChI

InChI=1S/C18H13N5OS/c24-16-8-7-12-4-1-2-6-14(12)15(16)11-20-23-17(21-22-18(23)25)13-5-3-9-19-10-13/h1-11,20H,(H,22,25)