Vitas-M small molecule compound
2-(azepan-1-ylmethyl)-6-[4-(methylsulfanyl)phenyl]pyridazin-3(2H)-one
Catalog ID
STL250397
SMILES CSc1ccc(cc1)c1ccc(=O)n(n1)CN1CCCCCC1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C18H23N3OS MW 329.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N3OS/c1-23-16-8-6-15(7-9-16)17-10-11-18(22)21(19-17)14-20-12-4-2-3-5-13-20/h6-11H,2-5,12-14H2,1H3InChIKey
HXKZMFCFZAWXHV-UHFFFAOYSA-NSynonyms
1351694-85-31351694853
2(azepan1ylmethyl)6(4(methylsulfanyl)phenyl)pyridazin3(2H)one
2(azepan1ylmethyl)6(4(methylthio)phenyl)pyridazin3(2H)one
2(azepan1ylmethyl)6(4methylsulfanylphenyl)pyridazin3one
CSC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CN3CCCCCC3
InChI=1SC18H23N3OSc123168615(7916)17101118(22)21(1917)14201242351320h611H251214H21H3
MFCD20537226
ZINC000072402207
ZINC72402207
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