Vitas-M small molecule compound
2-{2-[4-(1,1-dioxidotetrahydrothiophen-3-yl)piperazin-1-yl]-2-oxoethyl}-2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one
Catalog ID
STL160954
SMILES O=C(N1CCN(CC1)C1CCS(=O)(=O)C1)Cn1nc2CCCCCc2cc1=O
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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 C19H28N4O4S MW 408.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H28N4O4S/c24-18-12-15-4-2-1-3-5-17(15)20-23(18)13-19(25)22-9-7-21(8-10-22)16-6-11-28(26,27)14-16/h12,16H,1-11,13-14H2InChIKey
WBDPGWNUPGTDGJ-UHFFFAOYSA-NSynonyms
1324075-03-71324075037
2(2(4(11dioxidotetrahydrothiophen3yl)piperazin1yl)2oxoethyl)256789hexahydro3Hcyclohepta(c)pyridazin3one
2(2(4(11dioxidotetrahydrothiophen3yl)piperazin1yl)2oxoethyl)6789tetrahydro2Hcyclohepta(c)pyridazin3(5H)one
2(2(4(11dioxothiolan3yl)piperazin1yl)2oxoethyl)6789tetrahydro5Hcyclohepta(c)pyridazin3one
C1CCC2=CC(=O)N(N=C2CC1)CC(=O)N3CCN(CC3)C4CCS(=O)(=O)C4
InChI=1SC19H28N4O4Sc241812154213517(15)2023(18)1319(25)229721(81022)1661128(2627)1416h1216H1111314H2
MFCD19708663
ZINC000071280002
ZINC000071280003
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