Vitas-M small molecule compound
(4aR,7aS)-4-cycloheptyl-1-[4-(propan-2-yl)phenyl]hexahydrothieno[3,4-b]pyrazin-2(1H)-one 6,6-dioxide
Catalog ID
STK642532
SMILES O=C1CN(C2CCCCCC2)[C@@H]2[C@H](N1c1ccc(cc1)C(C)C)CS(=O)(=O)C2
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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 C22H32N2O3S MW 404.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H32N2O3S/c1-16(2)17-9-11-19(12-10-17)24-21-15-28(26,27)14-20(21)23(13-22(24)25)18-7-5-3-4-6-8-18/h9-12,16,18,20-21H,3-8,13-15H2,1-2H3/t20-,21+/m0/s1InChIKey
OLHOSTGLYPRTOV-LEWJYISDSA-NSynonyms
1214630-03-1(4aR7aS)4cycloheptyl1(4(propan2yl)phenyl)hexahydrothieno(34b)pyrazin2(1H)one66dioxide
(4aR7aS)4cycloheptyl1(4isopropylphenyl)hexahydrothieno(34b)pyrazin2(1H)one66dioxide
(4aS7aR)1cycloheptyl66dioxo4(4propan2ylphenyl)4a577atetrahydro2Hthieno(34b)pyrazin3one
1214630031
CC(C)C1=CC=C(C=C1)N2C3CS(=O)(=O)CC3N(CC2=O)C4CCCCCC4
InChI=1SC22H32N2O3Sc116(2)1791119(121017)24211528(2627)1420(21)23(1322(24)25)1875346818h91216182021H381315H212H3t2021+m0s1
MFCD18246713
O=C1CN(C2CCCCCC2)(C@@H)2(C@H)(N1c1ccc(cc1)C(C)C)CS(=O)(=O)C2
ZINC000055408769
ZINC55408769
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