Vitas-M small molecule compound
N-(2-methoxyphenyl)-2-[(5-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide
Catalog ID
STK829815
SMILES COc1ccccc1NC(=O)CSc1nnc2n1c(C)nc1c2c2CCCCc2s1
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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 C21H21N5O2S2 MW 439.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O2S2/c1-12-22-20-18(13-7-3-6-10-16(13)30-20)19-24-25-21(26(12)19)29-11-17(27)23-14-8-4-5-9-15(14)28-2/h4-5,8-9H,3,6-7,10-11H2,1-2H3,(H,23,27)InChIKey
FXDKNXOGRJMPSZ-UHFFFAOYSA-NSynonyms
384370-04-1384370041
CC1=NC2=C(C3=C(S2)CCCC3)C4=NN=C(N14)SCC(=O)NC5=CC=CC=C5OC
InChI=1SC21H21N5O2S2c112222018(137361016(13)3020)19242521(26(12)19)291117(27)2314845915(14)282h4589H3671011H212H3(H2327)
MFCD03281387
N(2methoxyphenyl)2((5methyl891011tetrahydro(1)benzothieno(32e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)acetamide
N(2methoxyphenyl)2((5methyl891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(43c)pyrimidin3yl)thio)acetamide
ZINC000000792361
ZINC00792361
ZINC792361
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