Vitas-M small molecule compound
(4aR,9bR)-N-(4-methoxyphenyl)-2,8-dimethyl-1,2,3,4,4a,9b-hexahydro-5H-pyrido[4,3-b]indole-5-carbothioamide
Catalog ID
STL564801
SMILES COc1ccc(cc1)NC(=S)N1c2ccc(cc2[C@H]2[C@H]1CCN(C2)C)C
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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 C21H25N3OS MW 367.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3OS/c1-14-4-9-19-17(12-14)18-13-23(2)11-10-20(18)24(19)21(26)22-15-5-7-16(25-3)8-6-15/h4-9,12,18,20H,10-11,13H2,1-3H3,(H,22,26)/t18-,20+/m0/s1InChIKey
FZLNTZOVDASIPF-AZUAARDMSA-NSynonyms
293727-77-2(4aR9bR)N(4methoxyphenyl)28dimethyl12344a9bhexahydro5Hpyrido(43b)indole5carbothioamide
(4aR9bR)N(4methoxyphenyl)28dimethyl2344atetrahydro1Hpyrido(43b)indole5(9bH)carbothioamide
(4aR9bR)N(4methoxyphenyl)28dimethyl344a9btetrahydro1Hpyrido(43b)indole5carbothioamide
293727772
6353632
COc1ccc(cc1)NC(=S)N1c2ccc(cc2(C@H)2(C@H)1CCN(C2)C)C
InChI=1SC21H25N3OSc114491917(1214)181323(2)111020(18)24(19)21(26)22155716(253)8615h49121820H101113H213H3(H2226)t1820+m0s1
MFCD32651570
ZINC000003999349
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