N-aminocarbonyl-3-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-propanamide

Systemtic Name: N-aminocarbonyl-3-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-propanamide Openeye Name: N-carbamoyl-3-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-propanamide CAS Name: N-carbamoyl-3-[[6-(3,5-dimethyl-1-pyrazolyl)-3-pyridazinyl]thio]propanamide IUPAC Name: N-carbamoyl-3-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylpropanamide Traditional Name: N-carbamoyl-3-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]thio]propionamide Formula: C13H16N6O2S MolecularWeight: 320.37014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NN=C(C=C2)SCCC(=O)NC(=O)N)C

Isomeric SMILES

CC1=CC(=NN1C2=NN=C(C=C2)SCCC(=O)NC(=O)N)C

InChI

InChI=1S/C13H16N6O2S/c1-8-7-9(2)19(18-8)10-3-4-12(17-16-10)22-6-5-11(20)15-13(14)21/h3-4,7H,5-6H2,1-2H3,(H3,14,15,20,21)