Vitas-M small molecule compound
(12aS)-2-[3-(dibutylamino)propyl]-6-(3-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL537193
SMILES CCCCN(CCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cccc(c2)OC)[nH]c2c1cccc2)CCCC
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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 C32H42N4O3 MW 530.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H42N4O3/c1-4-6-16-34(17-7-5-2)18-11-19-35-22-29(37)36-28(32(35)38)21-26-25-14-8-9-15-27(25)33-30(26)31(36)23-12-10-13-24(20-23)39-3/h8-10,12-15,20,28,31,33H,4-7,11,16-19,21-22H2,1-3H3/t28-,31?/m0/s1InChIKey
QVGDYEKEFSCDOK-NPHAVVRNSA-NSynonyms
956944-88-0(12aS)2(3(dibutylamino)propyl)6(3methoxyphenyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(12aS)2(3(dibutylamino)propyl)6(3methoxyphenyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))6(3(dibutylamino)propyl)2(3methoxyphenyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16399623
956944880
CCCCN(CCCN1CC(=O)N2(C@H)(C1=O)Cc1c(C2c2cccc(c2)OC)(nH)c2c1cccc2)CCCC
InChI=1SC32H42N4O3c1461634(17752)181119352229(37)3628(32(35)38)21262514891527(25)3330(26)31(36)2312101324(2023)393h810121520283133H471116192122H213H3t2831?m0s1
MFCD04144729
ZINC000002102371
ZINC000002102373
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