Vitas-M small molecule compound
2-{2-[4-(1,1-dioxidotetrahydrothiophen-3-yl)piperazin-1-yl]-2-oxoethyl}-6-(4-methoxyphenyl)pyridazin-3(2H)-one
Catalog ID
STL156324
SMILES COc1ccc(cc1)c1ccc(=O)n(n1)CC(=O)N1CCN(CC1)C1CCS(=O)(=O)C1
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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 C21H26N4O5S MW 446.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N4O5S/c1-30-18-4-2-16(3-5-18)19-6-7-20(26)25(22-19)14-21(27)24-11-9-23(10-12-24)17-8-13-31(28,29)15-17/h2-7,17H,8-15H2,1H3InChIKey
XOYFSBHCTJMMOW-UHFFFAOYSA-NSynonyms
1282103-68-71282103687
2(2(4(11dioxidotetrahydrothiophen3yl)piperazin1yl)2oxoethyl)6(4methoxyphenyl)pyridazin3(2H)one
2(2(4(11dioxothiolan3yl)piperazin1yl)2oxoethyl)6(4methoxyphenyl)pyridazin3one
COC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)N3CCN(CC3)C4CCS(=O)(=O)C4
InChI=1SC21H26N4O5Sc130184216(3518)196720(26)25(2219)1421(27)2411923(101224)1781331(2829)1517h2717H815H21H3
MFCD18799823
ZINC000061721488
ZINC000061721489
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