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

Systemtic Name: 2-[2-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylethanoylamino]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-2-[[2-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylacetyl]amino]benzamide CAS Name: 2-[[2-[[6-(3,5-dimethyl-1-pyrazolyl)-3-pyridazinyl]thio]-1-oxoethyl]amino]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-2-[[2-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylacetyl]amino]benzamide Traditional Name: N-benzyl-2-[[2-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]thio]acetyl]amino]benzamide Formula: C25H24N6O2S MolecularWeight: 472.56206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NN=C(C=C2)SCC(=O)NC3=CC=CC=C3C(=O)NCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=NN1C2=NN=C(C=C2)SCC(=O)NC3=CC=CC=C3C(=O)NCC4=CC=CC=C4)C

InChI

InChI=1S/C25H24N6O2S/c1-17-14-18(2)31(30-17)22-12-13-24(29-28-22)34-16-23(32)27-21-11-7-6-10-20(21)25(33)26-15-19-8-4-3-5-9-19/h3-14H,15-16H2,1-2H3,(H,26,33)(H,27,32)