Vitas-M small molecule compound
(12aS)-6-(3-chlorophenyl)-2-(3-hydroxypropyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL537241
SMILES OCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cccc(c2)Cl)[nH]c2c1cccc2
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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 C23H22ClN3O3 MW 423.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClN3O3/c24-15-6-3-5-14(11-15)22-21-17(16-7-1-2-8-18(16)25-21)12-19-23(30)26(9-4-10-28)13-20(29)27(19)22/h1-3,5-8,11,19,22,25,28H,4,9-10,12-13H2/t19-,22?/m0/s1InChIKey
OBWWTFNJSPIKTI-YDNXMHBPSA-NSynonyms
956961-16-3(12aS)6(3chlorophenyl)2(3hydroxypropyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(12aS)6(3chlorophenyl)2(3hydroxypropyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))2(3chlorophenyl)6(3hydroxypropyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16401253
956961163
InChI=1SC23H22ClN3O3c241563514(1115)222117(16712818(16)2521)121923(30)26(941028)1320(29)27(19)22h13581119222528H49101213H2t1922?m0s1
MFCD05673648
OCCCN1CC(=O)N2(C@H)(C1=O)Cc1c(C2c2cccc(c2)Cl)(nH)c2c1cccc2
ZINC000002116775
ZINC000002116777
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