Vitas-M small molecule compound
(11aR)-3-(4-methoxyphenyl)-2-{[(E)-(4-methoxyphenyl)methylidene]amino}-2,3,5,6,11,11a-hexahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-1-one
Catalog ID
STL527912
SMILES COc1ccc(cc1)C1N(/N=C/c2ccc(cc2)OC)C(=O)[C@@H]2N1Cc1[nH]c3c(c1C2)cccc3
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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 C28H26N4O3 MW 466.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N4O3/c1-34-20-11-7-18(8-12-20)16-29-32-27(19-9-13-21(35-2)14-10-19)31-17-25-23(15-26(31)28(32)33)22-5-3-4-6-24(22)30-25/h3-14,16,26-27,30H,15,17H2,1-2H3/b29-16+/t26-,27?/m1/s1InChIKey
AJLYEKAIOMKNBY-WKPZGNMWSA-NSynonyms
(11aR)3(4methoxyphenyl)2(((E)(4methoxyphenyl)methylidene)amino)23561111ahexahydro1Himidazo(1516)pyrido(34b)indol1one
(11aS)2((E)(4methoxybenzylidene)amino)3(4methoxyphenyl)23561111ahexahydro1Himidazo(1516)pyrido(34b)indol1one
(15~(R))12(4methoxyphenyl)13((~(E))(4methoxyphenyl)methylideneamino)81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraen14one
135639334
COc1ccc(cc1)C1N(N=Cc2ccc(cc2)OC)C(=O)(C@H)2N1Cc1(nH)c3c(c1C2)cccc3
InChI=1SC28H26N4O3c1342011718(81220)16293227(1991321(352)141019)31172523(1526(31)28(32)33)22534624(22)3025h31416262730H1517H212H3b2916+t2627?m1s1
MFCD03661951
ZINC000016042115
ZINC000037238852
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