3-[3-(4-methylphenyl)-6-oxidanylidene-pyridazin-1-yl]propanethioamide

Systemtic Name: 3-[3-(4-methylphenyl)-6-oxidanylidene-pyridazin-1-yl]propanethioamide Openeye Name: 3-[6-oxo-3-(p-tolyl)pyridazin-1-yl]propanethioamide CAS Name: 3-[3-(4-methylphenyl)-6-oxo-1-pyridazinyl]propanethioamide IUPAC Name: 3-[3-(4-methylphenyl)-6-oxopyridazin-1-yl]propanethioamide Traditional Name: 3-[6-keto-3-(p-tolyl)pyridazin-1-yl]thiopropionamide Formula: C14H15N3OS MolecularWeight: 273.3534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCC(=S)N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCC(=S)N

InChI

InChI=1S/C14H15N3OS/c1-10-2-4-11(5-3-10)12-6-7-14(18)17(16-12)9-8-13(15)19/h2-7H,8-9H2,1H3,(H2,15,19)