Vitas-M small molecule compound
(11aS)-5-(4-methoxyphenyl)-2-(prop-2-en-1-yl)-3-thioxo-2,3,5,6,11,11a-hexahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-1-one
Catalog ID
STL525146
SMILES C=CCN1C(=O)[C@H]2N(C1=S)C(c1ccc(cc1)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 C23H21N3O2S MW 403.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O2S/c1-3-12-25-22(27)19-13-17-16-6-4-5-7-18(16)24-20(17)21(26(19)23(25)29)14-8-10-15(28-2)11-9-14/h3-11,19,21,24H,1,12-13H2,2H3/t19-,21?/m0/s1InChIKey
UDVMTDCIAPQHNE-ZQRQZVKFSA-NSynonyms
314727-80-5(11aS)2allyl5(4methoxyphenyl)3thioxo23561111ahexahydro1Himidazo(1516)pyrido(34b)indol1one
(11aS)5(4methoxyphenyl)2(prop2en1yl)3thioxo23561111ahexahydro1Himidazo(1516)pyrido(34b)indol1one
(15~(S))10(4methoxyphenyl)13prop2enyl12sulfanylidene81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraen14one
16395472
314727805
C=CCN1C(=O)(C@H)2N(C1=S)C(c1ccc(cc1)OC)c1c(C2)c2ccccc2(nH)1
InChI=1SC23H21N3O2Sc13122522(27)19131716645718(16)2420(17)21(26(19)23(25)29)1481015(282)11914h311192124H11213H22H3t1921?m0s1
MFCD01081859
ZINC000002097597
ZINC000002097599
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