Vitas-M small molecule compound
(12aS)-6-(4-bromophenyl)-2-[3-(propan-2-yloxy)propyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL538046
SMILES CC(OCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(cc2)Br)[nH]c2c1cccc2)C
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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 C26H28BrN3O3 MW 510.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28BrN3O3/c1-16(2)33-13-5-12-29-15-23(31)30-22(26(29)32)14-20-19-6-3-4-7-21(19)28-24(20)25(30)17-8-10-18(27)11-9-17/h3-4,6-11,16,22,25,28H,5,12-15H2,1-2H3/t22-,25?/m0/s1InChIKey
UQAAVYHMHJSEIZ-XADRRFQNSA-NSynonyms
956968-57-3(12aS)6(4bromophenyl)2(3(propan2yloxy)propyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)6(4bromophenyl)2(3isopropoxypropyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(S))2(4bromophenyl)6(3propan2yloxypropyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16400019
956968573
CC(OCCCN1CC(=O)N2(C@H)(C1=O)Cc1c(C2c2ccc(cc2)Br)(nH)c2c1cccc2)C
InChI=1SC26H28BrN3O3c116(2)3313512291523(31)3022(26(29)32)142019634721(19)2824(20)25(30)1781018(27)11917h3461116222528H51215H212H3t2225?m0s1
MFCD04147098
ZINC000002108333
ZINC000002108334
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