Vitas-M small molecule compound
4-methyl-6-({3-[4-(methylsulfanyl)phenyl]-6-oxopyridazin-1(6H)-yl}acetyl)-2H-1,4-benzoxazin-3(4H)-one
Catalog ID
STK935511
SMILES CSc1ccc(cc1)c1ccc(=O)n(n1)CC(=O)c1ccc2c(c1)N(C)C(=O)CO2
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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 C22H19N3O4S MW 421.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O4S/c1-24-18-11-15(5-9-20(18)29-13-22(24)28)19(26)12-25-21(27)10-8-17(23-25)14-3-6-16(30-2)7-4-14/h3-11H,12-13H2,1-2H3InChIKey
OPTHXFIAISXZRT-UHFFFAOYSA-NSynonyms
1232767-57-51232767575
4methyl6((3(4(methylsulfanyl)phenyl)6oxopyridazin1(6H)yl)acetyl)2H14benzoxazin3(4H)one
4methyl6(2(3(4(methylthio)phenyl)6oxopyridazin1(6H)yl)acetyl)2Hbenzo(b)(14)oxazin3(4H)one
4methyl6(2(3(4methylsulfanylphenyl)6oxopyridazin1yl)acetyl)14benzoxazin3one
CN1C(=O)COC2=C1C=C(C=C2)C(=O)CN3C(=O)C=CC(=N3)C4=CC=C(C=C4)SC
InChI=1SC22H19N3O4Sc124181115(5920(18)291322(24)28)19(26)122521(27)10817(2325)143616(302)7414h311H1213H212H3
MFCD18065505
ZINC000044901274
ZINC44901274
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