N-[3-(3-methylsulfanyl-1,2,4-triazol-4-yl)phenyl]-6-oxidanylidene-1-phenyl-pyridazine-3-carboxamide

Systemtic Name: N-[3-(3-methylsulfanyl-1,2,4-triazol-4-yl)phenyl]-6-oxidanylidene-1-phenyl-pyridazine-3-carboxamide Openeye Name: N-[3-(3-methylsulfanyl-1,2,4-triazol-4-yl)phenyl]-6-oxo-1-phenyl-pyridazine-3-carboxamide CAS Name: N-[3-[3-(methylthio)-1,2,4-triazol-4-yl]phenyl]-6-oxo-1-phenyl-3-pyridazinecarboxamide IUPAC Name: N-[3-(3-methylsulfanyl-1,2,4-triazol-4-yl)phenyl]-6-oxo-1-phenylpyridazine-3-carboxamide Traditional Name: 6-keto-N-[3-[3-(methylthio)-1,2,4-triazol-4-yl]phenyl]-1-phenyl-pyridazine-3-carboxamide Formula: C20H16N6O2S MolecularWeight: 404.44504

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=CN1C2=CC(=CC=C2)NC(=O)C3=NN(C(=O)C=C3)C4=CC=CC=C4

Isomeric SMILES

CSC1=NN=CN1C2=CC(=CC=C2)NC(=O)C3=NN(C(=O)C=C3)C4=CC=CC=C4

InChI

InChI=1S/C20H16N6O2S/c1-29-20-23-21-13-25(20)16-9-5-6-14(12-16)22-19(28)17-10-11-18(27)26(24-17)15-7-3-2-4-8-15/h2-13H,1H3,(H,22,28)