N-[4-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylmethyl]-2-oxidanylidene-chromen-7-yl]ethanamide

Systemtic Name: N-[4-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylmethyl]-2-oxidanylidene-chromen-7-yl]ethanamide Openeye Name: N-[4-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylmethyl]-2-oxo-chromen-7-yl]acetamide CAS Name: N-[4-[[[6-(3,5-dimethyl-1-pyrazolyl)-3-pyridazinyl]thio]methyl]-2-oxo-1-benzopyran-7-yl]acetamide IUPAC Name: N-[4-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylmethyl]-2-oxochromen-7-yl]acetamide Traditional Name: N-[4-[[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]thio]methyl]-2-keto-chromen-7-yl]acetamide Formula: C21H19N5O3S MolecularWeight: 421.47226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NN=C(C=C2)SCC3=CC(=O)OC4=C3C=CC(=C4)NC(=O)C)C

Isomeric SMILES

CC1=CC(=NN1C2=NN=C(C=C2)SCC3=CC(=O)OC4=C3C=CC(=C4)NC(=O)C)C

InChI

InChI=1S/C21H19N5O3S/c1-12-8-13(2)26(25-12)19-6-7-20(24-23-19)30-11-15-9-21(28)29-18-10-16(22-14(3)27)4-5-17(15)18/h4-10H,11H2,1-3H3,(H,22,27)