Vitas-M small molecule compound
N-(4-bromophenyl)-2-[(4-methyl-5-oxo-4,5,6,7,8,9-hexahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)sulfanyl]acetamide
Catalog ID
STK720524
SMILES O=C(Nc1ccc(cc1)Br)CSc1nnc2n1c1sc3c(c1c(=O)n2C)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 C20H18BrN5O2S2 MW 504.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18BrN5O2S2/c1-25-17(28)16-13-4-2-3-5-14(13)30-18(16)26-19(25)23-24-20(26)29-10-15(27)22-12-8-6-11(21)7-9-12/h6-9H,2-5,10H2,1H3,(H,22,27)InChIKey
VYOVNQGVAQCJAA-UHFFFAOYSA-NSynonyms
496797-95-6496797956
CN1C(=O)C2=C(N3C1=NN=C3SCC(=O)NC4=CC=C(C=C4)Br)SC5=C2CCCC5
InChI=1SC20H18BrN5O2S2c12517(28)1613423514(13)3018(16)2619(25)232420(26)291015(27)22128611(21)7912h69H2510H21H3(H2227)
MFCD03298983
N(4bromophenyl)2((4methyl5oxo456789hexahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin1yl)sulfanyl)acetamide
N(4bromophenyl)2((4methyl5oxo456789hexahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin1yl)thio)acetamide
ZINC000001297771
ZINC01297771
ZINC1297771
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