Vitas-M small molecule compound
(4aR,7aS)-4-cyclopentyl-1-(3-methoxyphenyl)hexahydrothieno[3,4-b]pyrazin-2(1H)-one 6,6-dioxide
Catalog ID
STK646968
SMILES COc1cccc(c1)N1C(=O)CN([C@@H]2[C@H]1CS(=O)(=O)C2)C1CCCC1
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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 C18H24N2O4S MW 364.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24N2O4S/c1-24-15-8-4-7-14(9-15)20-17-12-25(22,23)11-16(17)19(10-18(20)21)13-5-2-3-6-13/h4,7-9,13,16-17H,2-3,5-6,10-12H2,1H3/t16-,17+/m0/s1InChIKey
RWQFHHUEPDFIFT-DLBZAZTESA-NSynonyms
1212444-07-9(4aR7aS)4cyclopentyl1(3methoxyphenyl)hexahydrothieno(34b)pyrazin2(1H)one66dioxide
(4aS7aR)1cyclopentyl4(3methoxyphenyl)66dioxo4a577atetrahydro2Hthieno(34b)pyrazin3one
1212444079
COC1=CC=CC(=C1)N2C3CS(=O)(=O)CC3N(CC2=O)C4CCCC4
COc1cccc(c1)N1C(=O)CN((C@@H)2(C@H)1CS(=O)(=O)C2)C1CCCC1
InChI=1SC18H24N2O4Sc1241584714(915)20171225(2223)1116(17)19(1018(20)21)13523613h479131617H23561012H21H3t1617+m0s1
MFCD18246786
ZINC000057177871
ZINC57177871
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