N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-propanamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-propanamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-3-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-propanamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-[[6-(3,5-dimethyl-1-pyrazolyl)-3-pyridazinyl]thio]propanamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylpropanamide Traditional Name: 3-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]thio]-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)propionamide Formula: C23H25N7O2S MolecularWeight: 463.5553

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NN=C(C=C2)SCCC(=O)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C)C

Isomeric SMILES

CC1=CC(=NN1C2=NN=C(C=C2)SCCC(=O)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C)C

InChI

InChI=1S/C23H25N7O2S/c1-15-14-16(2)29(27-15)19-10-11-21(26-25-19)33-13-12-20(31)24-22-17(3)28(4)30(23(22)32)18-8-6-5-7-9-18/h5-11,14H,12-13H2,1-4H3,(H,24,31)