Vitas-M small molecule compound
ethyl {[5-(2-chlorophenyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}acetate
Catalog ID
STK551147
SMILES CCOC(=O)CSc1nnc2n1c(nc1c2c2CCCCc2s1)c1ccccc1Cl
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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 C21H19ClN4O2S2 MW 458.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN4O2S2/c1-2-28-16(27)11-29-21-25-24-19-17-13-8-4-6-10-15(13)30-20(17)23-18(26(19)21)12-7-3-5-9-14(12)22/h3,5,7,9H,2,4,6,8,10-11H2,1H3InChIKey
ZVDODZKNFCQKNB-UHFFFAOYSA-NSynonyms
799778-12-4799778124
CCOC(=O)CSC1=NN=C2N1C(=NC3=C2C4=C(S3)CCCC4)C5=CC=CC=C5Cl
ethyl((5(2chlorophenyl)891011tetrahydro(1)benzothieno(32e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)acetate
ethyl2((5(2chlorophenyl)891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(43c)pyrimidin3yl)thio)acetate
InChI=1SC21H19ClN4O2S2c122816(27)11292125241917138461015(13)3020(17)2318(26(19)21)12735914(12)22h3579H24681011H21H3
MFCD03673412
ZINC000002210292
ZINC02210292
ZINC2210292
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