Vitas-M small molecule compound
(11aS)-2-ethyl-3-thioxo-5-(3,4,5-trimethoxyphenyl)-2,3,5,6,11,11a-hexahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-1-one
Catalog ID
STL524671
SMILES CCN1C(=O)[C@H]2N(C1=S)C(c1cc(OC)c(c(c1)OC)OC)c1c(C2)c2ccccc2[nH]1
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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 C24H25N3O4S MW 451.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O4S/c1-5-26-23(28)17-12-15-14-8-6-7-9-16(14)25-20(15)21(27(17)24(26)32)13-10-18(29-2)22(31-4)19(11-13)30-3/h6-11,17,21,25H,5,12H2,1-4H3/t17-,21?/m0/s1InChIKey
MIXRCGVCFFHVIK-PBVYKCSPSA-NSynonyms
308797-93-5(11aS)2ethyl3thioxo5(345trimethoxyphenyl)23561111ahexahydro1Himidazo(1516)pyrido(34b)indol1one
(15~(S))13ethyl12sulfanylidene10(345trimethoxyphenyl)81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraen14one
16395212
308797935
CCN1C(=O)(C@H)2N(C1=S)C(c1cc(OC)c(c(c1)OC)OC)c1c(C2)c2ccccc2(nH)1
InChI=1SC24H25N3O4Sc152623(28)17121514867916(14)2520(15)21(27(17)24(26)32)131018(292)22(314)19(1113)303h611172125H512H214H3t1721?m0s1
MFCD01544113
ZINC000000763021
ZINC000001229891
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