Vitas-M small molecule compound
1-(2,8-dimethyl-1,2,3,4,4a,9b-hexahydro-5H-pyrido[4,3-b]indol-5-yl)-2-{[1-(4-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}ethanone
Catalog ID
STK679180
SMILES COc1ccc(cc1)n1nnnc1SCC(=O)N1c2ccc(cc2C2C1CCN(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 C23H26N6O2S MW 450.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N6O2S/c1-15-4-9-20-18(12-15)19-13-27(2)11-10-21(19)28(20)22(30)14-32-23-24-25-26-29(23)16-5-7-17(31-3)8-6-16/h4-9,12,19,21H,10-11,13-14H2,1-3H3InChIKey
MFOMDGQAIVKJQL-UHFFFAOYSA-NSynonyms
1(28dimethyl12344a9bhexahydro5Hpyrido(43b)indol5yl)2((1(4methoxyphenyl)1Htetrazol5yl)sulfanyl)ethanone
1(28DIMETHYL344A9BTETRAHYDRO1HPYRIDO(43B)INDOL5YL)2(1(4METHOXYPHENYL)TETRAZOL5YL)SULFANYLETHANONE
CC1=CC2=C(C=C1)N(C3C2CN(CC3)C)C(=O)CSC4=NN=NN4C5=CC=C(C=C5)OC
InChI=1SC23H26N6O2Sc115492018(1215)191327(2)111021(19)28(20)22(30)14322324252629(23)165717(313)8616h49121921H10111314H213H3
MFCD03408636
ZINC000008867832
ZINC000103001203
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