Vitas-M small molecule compound
(11aR)-2-{[(E)-(4-methoxyphenyl)methylidene]amino}-3-(4-methylphenyl)-2,3,5,6,11,11a-hexahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-1-one
Catalog ID
STL528228
SMILES COc1ccc(cc1)/C=N/N1C(c2ccc(cc2)C)N2[C@@H](C1=O)Cc1c(C2)[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 C28H26N4O2 MW 450.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N4O2/c1-18-7-11-20(12-8-18)27-31-17-25-23(22-5-3-4-6-24(22)30-25)15-26(31)28(33)32(27)29-16-19-9-13-21(34-2)14-10-19/h3-14,16,26-27,30H,15,17H2,1-2H3/b29-16+/t26-,27?/m1/s1InChIKey
RPWXJMZIBGOAJD-WKPZGNMWSA-NSynonyms
956980-06-6(11aR)2(((E)(4methoxyphenyl)methylidene)amino)3(4methylphenyl)23561111ahexahydro1Himidazo(1516)pyrido(34b)indol1one
(11aR)2((E)(4methoxybenzylidene)amino)3(ptolyl)23561111ahexahydro1Himidazo(1516)pyrido(34b)indol1one
(15~(R))13((~(E))(4methoxyphenyl)methylideneamino)12(4methylphenyl)81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraen14one
16398763
956980066
COc1ccc(cc1)C=NN1C(c2ccc(cc2)C)N2(C@@H)(C1=O)Cc1c(C2)(nH)c2c1cccc2
InChI=1SC28H26N4O2c11871120(12818)2731172523(22534624(22)3025)1526(31)28(33)32(27)29161991321(342)141019h31416262730H1517H212H3b2916+t2627?m1s1
MFCD03851648
ZINC000035494228
ZINC000035494232
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