Vitas-M small molecule compound
2-{[5-(2-chlorophenyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}-N-(4-phenylbutan-2-yl)acetamide
Catalog ID
STK552077
SMILES CC(NC(=O)CSc1nnc2n1c(nc1c2c2CCCCc2s1)c1ccccc1Cl)CCc1ccccc1
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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 C29H28ClN5OS2 MW 562.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28ClN5OS2/c1-18(15-16-19-9-3-2-4-10-19)31-24(36)17-37-29-34-33-27-25-21-12-6-8-14-23(21)38-28(25)32-26(35(27)29)20-11-5-7-13-22(20)30/h2-5,7,9-11,13,18H,6,8,12,14-17H2,1H3,(H,31,36)InChIKey
STQYVUUOKDQHJI-UHFFFAOYSA-NSynonyms
2((5(2chlorophenyl)891011tetrahydro(1)benzothieno(32e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)N(4phenylbutan2yl)acetamide
2((5(2chlorophenyl)891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(43c)pyrimidin3yl)thio)N(4phenylbutan2yl)acetamide
CC(CCC1=CC=CC=C1)NC(=O)CSC2=NN=C3N2C(=NC4=C3C5=C(S4)CCCC5)C6=CC=CC=C6Cl
InChI=1SC29H28ClN5OS2c118(15161993241019)3124(36)173729343327252112681423(21)3828(25)3226(35(27)29)2011571322(20)30h2579111318H68121417H21H3(H3136)
MFCD03678190
ZINC000001873033
ZINC000001873036
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