Vitas-M small molecule compound
N-(4-chlorophenyl)-2-{[5-(methylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}acetamide
Catalog ID
STK550553
SMILES CSc1nc2sc3c(c2c2n1c(SCC(=O)Nc1ccc(cc1)Cl)nn2)CCCC3
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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 C20H18ClN5OS3 MW 476.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClN5OS3/c1-28-19-23-18-16(13-4-2-3-5-14(13)30-18)17-24-25-20(26(17)19)29-10-15(27)22-12-8-6-11(21)7-9-12/h6-9H,2-5,10H2,1H3,(H,22,27)InChIKey
JXHPCBAPNYUJRO-UHFFFAOYSA-NSynonyms
799824-99-0799824990
CSC1=NC2=C(C3=C(S2)CCCC3)C4=NN=C(N41)SCC(=O)NC5=CC=C(C=C5)Cl
InChI=1SC20H18ClN5OS3c12819231816(13423514(13)3018)17242520(26(17)19)291015(27)22128611(21)7912h69H2510H21H3(H2227)
MFCD03682893
N(4chlorophenyl)2((5(methylsulfanyl)891011tetrahydro(1)benzothieno(32e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)acetamide
N(4chlorophenyl)2((5(methylthio)891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(43c)pyrimidin3yl)thio)acetamide
ZINC000002238442
ZINC02238442
ZINC2238442
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