Vitas-M small molecule compound
2-{[1-(1,3-benzodioxol-5-yl)-1H-tetrazol-5-yl]sulfanyl}-1-(2,8-dimethyl-1,2,3,4,4a,9b-hexahydro-5H-pyrido[4,3-b]indol-5-yl)ethanone
Catalog ID
STK678074
SMILES CN1CCC2C(C1)c1cc(C)ccc1N2C(=O)CSc1nnnn1c1ccc2c(c1)OCO2
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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 C23H24N6O3S MW 464.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N6O3S/c1-14-3-5-18-16(9-14)17-11-27(2)8-7-19(17)28(18)22(30)12-33-23-24-25-26-29(23)15-4-6-20-21(10-15)32-13-31-20/h3-6,9-10,17,19H,7-8,11-13H2,1-2H3InChIKey
NJOVNBSOIMLIGF-UHFFFAOYSA-NSynonyms
2((1(13benzodioxol5yl)1Htetrazol5yl)sulfanyl)1(28dimethyl12344a9bhexahydro5Hpyrido(43b)indol5yl)ethanone
2(1(13BENZODIOXOL5YL)TETRAZOL5YL)SULFANYL1(28DIMETHYL344A9BTETRAHYDRO1HPYRIDO(43B)INDOL5YL)ETHANONE
CC1=CC2=C(C=C1)N(C3C2CN(CC3)C)C(=O)CSC4=NN=NN4C5=CC6=C(C=C5)OCO6
InChI=1SC23H24N6O3Sc114351816(914)171127(2)8719(17)28(18)22(30)12332324252629(23)15462021(1015)32133120h369101719H781113H212H3
MFCD03018008
ZINC000001088417
ZINC000015240419
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