Vitas-M small molecule compound
(11aS)-2-(prop-2-en-1-yl)-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
STL524386
SMILES C=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 C25H25N3O4S MW 463.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O4S/c1-5-10-27-24(29)18-13-16-15-8-6-7-9-17(15)26-21(16)22(28(18)25(27)33)14-11-19(30-2)23(32-4)20(12-14)31-3/h5-9,11-12,18,22,26H,1,10,13H2,2-4H3/t18-,22?/m0/s1InChIKey
XEBXJYUSOZNJQA-HXBUSHRASA-NSynonyms
313673-63-1(11aS)2(prop2en1yl)3thioxo5(345trimethoxyphenyl)23561111ahexahydro1Himidazo(1516)pyrido(34b)indol1one
(11aS)2allyl3thioxo5(345trimethoxyphenyl)23561111ahexahydro1Himidazo(1516)pyrido(34b)indol1one
(15~(S))13prop2enyl12sulfanylidene10(345trimethoxyphenyl)81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraen14one
16395524
313673631
C=CCN1C(=O)(C@H)2N(C1=S)C(c1cc(OC)c(c(c1)OC)OC)c1c(C2)c2ccccc2(nH)1
InChI=1SC25H25N3O4Sc15102724(29)18131615867917(15)2621(16)22(28(18)25(27)33)141119(302)23(324)20(1214)313h591112182226H11013H224H3t1822?m0s1
MFCD01083123
ZINC000002097777
ZINC000012654989
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