Vitas-M small molecule compound
(3Z,12aS)-3-benzylidene-6,6-dimethyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL527261
SMILES O=C1N/C(=C\c2ccccc2)/C(=O)N2[C@H]1Cc1c3ccccc3[nH]c1C2(C)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 C23H21N3O2 MW 371.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O2/c1-23(2)20-16(15-10-6-7-11-17(15)24-20)13-19-21(27)25-18(22(28)26(19)23)12-14-8-4-3-5-9-14/h3-12,19,24H,13H2,1-2H3,(H,25,27)/b18-12-/t19-/m0/s1InChIKey
HAUDLZPBECEVBO-OVCORXIESA-NSynonyms
956362-93-9(3Z12aS)3benzylidene66dimethyl23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(5~(Z)8~(S))5benzylidene22dimethyl3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
(SZ)3benzylidene66dimethyl231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
5576432
956362939
InChI=1SC23H21N3O2c123(2)2016(1510671117(15)2420)131921(27)2518(22(28)26(19)23)12148435914h3121924H13H212H3(H2527)b1812t19m0s1
MFCD03267591
O=C1NC(=Cc2ccccc2)C(=O)N2(C@H)1Cc1c3ccccc3(nH)c1C2(C)C
ZINC000002121631
ZINC2121631
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