Vitas-M small molecule compound
(4aR,7aS)-4-cyclohexyl-1-[4-(propan-2-yl)phenyl]hexahydrothieno[3,4-b]pyrazin-2(1H)-one 6,6-dioxide
Catalog ID
STK635861
SMILES O=C1CN(C2CCCCC2)[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 C21H30N2O3S MW 390.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H30N2O3S/c1-15(2)16-8-10-18(11-9-16)23-20-14-27(25,26)13-19(20)22(12-21(23)24)17-6-4-3-5-7-17/h8-11,15,17,19-20H,3-7,12-14H2,1-2H3/t19-,20+/m0/s1InChIKey
MIPQCOABFLNVGW-VQTJNVASSA-NSynonyms
1212450-26-4(4aR7aS)4cyclohexyl1(4(propan2yl)phenyl)hexahydrothieno(34b)pyrazin2(1H)one66dioxide
(4aR7aS)4cyclohexyl1(4isopropylphenyl)hexahydrothieno(34b)pyrazin2(1H)one66dioxide
(4aS7aR)1cyclohexyl66dioxo4(4propan2ylphenyl)4a577atetrahydro2Hthieno(34b)pyrazin3one
1212450264
CC(C)C1=CC=C(C=C1)N2C3CS(=O)(=O)CC3N(CC2=O)C4CCCCC4
InChI=1SC21H30N2O3Sc115(2)1681018(11916)23201427(2526)1319(20)22(1221(23)24)176435717h81115171920H371214H212H3t1920+m0s1
MFCD18246604
O=C1CN(C2CCCCC2)(C@@H)2(C@H)(N1c1ccc(cc1)C(C)C)CS(=O)(=O)C2
ZINC000055408718
ZINC55408718
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