Vitas-M small molecule compound
2-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethyl]-6-(thiophen-2-yl)pyridazin-3(2H)-one
Catalog ID
STL152039
SMILES O=C(N1CCC2(C(C1)CCCC2)O)Cn1nc(ccc1=O)c1cccs1
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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 C19H23N3O3S MW 373.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23N3O3S/c23-17-7-6-15(16-5-3-11-26-16)20-22(17)13-18(24)21-10-9-19(25)8-2-1-4-14(19)12-21/h3,5-7,11,14,25H,1-2,4,8-10,12-13H2InChIKey
FPOIDXGBOMOFHP-UHFFFAOYSA-NSynonyms
2(2((4aS8aS)4ahydroxyoctahydroisoquinolin2(1H)yl)2oxoethyl)6(thiophen2yl)pyridazin3(2H)one
2(2(4ahydroxy13456788aoctahydroisoquinolin2yl)2oxoethyl)6thiophen2ylpyridazin3one
2(2(4ahydroxyoctahydroisoquinolin2(1H)yl)2oxoethyl)6(thiophen2yl)pyridazin3(2H)one
C1CCC2(CCN(CC2C1)C(=O)CN3C(=O)C=CC(=N3)C4=CC=CS4)O
InChI=1SC19H23N3O3Sc23177615(1653112616)2022(17)1318(24)2110919(25)821414(19)1221h357111425H1248101213H2
MFCD20756212
O=C(N1CC(C@@)2((C@H)(C1)CCCC2)O)Cn1nc(ccc1=O)c1cccs1
ZINC000071283934
ZINC000071328794
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