Vitas-M small molecule compound
(4aR,7aS)-1-(3-chloro-4-methoxyphenyl)-4-(furan-2-ylmethyl)hexahydrothieno[3,4-b]pyrazin-2(1H)-one 6,6-dioxide
Catalog ID
STK633951
SMILES COc1ccc(cc1Cl)N1C(=O)CN([C@@H]2[C@H]1CS(=O)(=O)C2)Cc1ccco1
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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 C18H19ClN2O5S MW 410.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19ClN2O5S/c1-25-17-5-4-12(7-14(17)19)21-16-11-27(23,24)10-15(16)20(9-18(21)22)8-13-3-2-6-26-13/h2-7,15-16H,8-11H2,1H3/t15-,16+/m0/s1InChIKey
HKOZDFHLZRTEFC-JKSUJKDBSA-NSynonyms
1212446-25-7(4aR7aS)1(3chloro4methoxyphenyl)4(furan2ylmethyl)hexahydrothieno(34b)pyrazin2(1H)one66dioxide
(4aS7aR)4(3chloro4methoxyphenyl)1(furan2ylmethyl)66dioxo4a577atetrahydro2Hthieno(34b)pyrazin3one
1212446257
COC1=C(C=C(C=C1)N2C3CS(=O)(=O)CC3N(CC2=O)CC4=CC=CO4)Cl
COc1ccc(cc1Cl)N1C(=O)CN((C@@H)2(C@H)1CS(=O)(=O)C2)Cc1ccco1
InChI=1SC18H19ClN2O5Sc125175412(714(17)19)21161127(2324)1015(16)20(918(21)22)8133262613h271516H811H21H3t1516+m0s1
MFCD18246575
ZINC000055408628
ZINC55408628
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