Vitas-M small molecule compound
(12aS)-2-[3-(dibutylamino)propyl]-6,6-dimethyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL526585
SMILES CCCCN(CCCC)CCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2(C)C)[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 C27H40N4O2 MW 452.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H40N4O2/c1-5-7-14-29(15-8-6-2)16-11-17-30-19-24(32)31-23(26(30)33)18-21-20-12-9-10-13-22(20)28-25(21)27(31,3)4/h9-10,12-13,23,28H,5-8,11,14-19H2,1-4H3/t23-/m0/s1InChIKey
JVIMPGGISOZUKM-QHCPKHFHSA-NSynonyms
956048-09-2(12aS)2(3(dibutylamino)propyl)66dimethyl23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))6(3(dibutylamino)propyl)22dimethyl3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
(S)2(3(dibutylamino)propyl)66dimethyl231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
1761950
956048092
CCCCN(CCCC)CCCN1CC(=O)N2(C@H)(C1=O)Cc1c(C2(C)C)(nH)c2c1cccc2
InChI=1SC27H40N4O2c1571429(15862)161117301924(32)3123(26(30)33)182120129101322(20)2825(21)27(313)4h91012132328H58111419H214H3t23m0s1
MFCD03266247
ZINC000002106961
ZINC2106961
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