2-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-N-[(1R)-3-methyl-1-phenyl-butyl]ethanamide

Systemtic Name: 2-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-N-[(1R)-3-methyl-1-phenyl-butyl]ethanamide Openeye Name: 2-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-N-[(1R)-3-methyl-1-phenyl-butyl]acetamide CAS Name: 2-[[6-(3,5-dimethyl-1-pyrazolyl)-3-pyridazinyl]thio]-N-[(1R)-3-methyl-1-phenylbutyl]acetamide IUPAC Name: 2-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-N-[(1R)-3-methyl-1-phenylbutyl]acetamide Traditional Name: 2-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]thio]-N-[(1R)-3-methyl-1-phenyl-butyl]acetamide Formula: C22H27N5OS MolecularWeight: 409.54768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NN=C(C=C2)SCC(=O)NC(CC(C)C)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NN1C2=NN=C(C=C2)SCC(=O)N[C@H](CC(C)C)C3=CC=CC=C3)C

InChI

InChI=1S/C22H27N5OS/c1-15(2)12-19(18-8-6-5-7-9-18)23-21(28)14-29-22-11-10-20(24-25-22)27-17(4)13-16(3)26-27/h5-11,13,15,19H,12,14H2,1-4H3,(H,23,28)/t19-/m1/s1