4-[2-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylethanoylamino]-N-methyl-benzamide

Systemtic Name: 4-[2-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylethanoylamino]-N-methyl-benzamide Openeye Name: 4-[[2-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylacetyl]amino]-N-methyl-benzamide CAS Name: 4-[[2-[[6-(3,5-dimethyl-1-pyrazolyl)-3-pyridazinyl]thio]-1-oxoethyl]amino]-N-methylbenzamide IUPAC Name: 4-[[2-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylacetyl]amino]-N-methylbenzamide Traditional Name: 4-[[2-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]thio]acetyl]amino]-N-methyl-benzamide Formula: C19H20N6O2S MolecularWeight: 396.4661

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NN=C(C=C2)SCC(=O)NC3=CC=C(C=C3)C(=O)NC)C

Isomeric SMILES

CC1=CC(=NN1C2=NN=C(C=C2)SCC(=O)NC3=CC=C(C=C3)C(=O)NC)C

InChI

InChI=1S/C19H20N6O2S/c1-12-10-13(2)25(24-12)16-8-9-18(23-22-16)28-11-17(26)21-15-6-4-14(5-7-15)19(27)20-3/h4-10H,11H2,1-3H3,(H,20,27)(H,21,26)