6-chloranyl-2-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 6-chloranyl-2-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 6-chloro-2-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 6-chloro-2-[[[6-(3,5-dimethyl-1-pyrazolyl)-3-pyridazinyl]thio]methyl]-1H-quinazolin-4-one IUPAC Name: 6-chloro-2-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 6-chloro-2-[[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]thio]methyl]-1H-quinazolin-4-one Formula: C18H15ClN6OS MolecularWeight: 398.8693

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NN=C(C=C2)SCC3=NC(=O)C4=C(N3)C=CC(=C4)Cl)C

Isomeric SMILES

CC1=CC(=NN1C2=NN=C(C=C2)SCC3=NC(=O)C4=C(N3)C=CC(=C4)Cl)C

InChI

InChI=1S/C18H15ClN6OS/c1-10-7-11(2)25(24-10)16-5-6-17(23-22-16)27-9-15-20-14-4-3-12(19)8-13(14)18(26)21-15/h3-8H,9H2,1-2H3,(H,20,21,26)