Vitas-M small molecule compound
(12bR)-12b-methyl-2-{[(E)-pyridin-3-ylmethylidene]amino}-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL537520
SMILES O=C1CN(/N=C/c2cccnc2)C(=O)[C@@]2(N1CCc1c2[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 C21H19N5O2 MW 373.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N5O2/c1-21-19-16(15-6-2-3-7-17(15)24-19)8-10-25(21)18(27)13-26(20(21)28)23-12-14-5-4-9-22-11-14/h2-7,9,11-12,24H,8,10,13H2,1H3/b23-12+/t21-/m1/s1InChIKey
AXCCCCJTQLZMPF-OVRHDEQLSA-NSynonyms
956528-24-8(12bR)12bmethyl2(((E)pyridin3ylmethylidene)amino)23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(2~(R))2methyl4((~(E))pyridin3ylmethylideneamino)4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
(RE)12bmethyl2((pyridin3ylmethylene)amino)2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
956528248
9692041
InChI=1SC21H19N5O2c1211916(15623717(15)2419)81025(21)18(27)1326(20(21)28)231214549221114h279111224H81013H21H3b2312+t21m1s1
MFCD03851366
O=C1CN(N=Cc2cccnc2)C(=O)(C@@)2(N1CCc1c2(nH)c2c1cccc2)C
ZINC000004045617
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