Vitas-M small molecule compound
2-[(5-oxo-4-phenyl-4,5,6,7,8,9-hexahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)sulfanyl]-N,N-diphenylacetamide
Catalog ID
STK720534
SMILES O=C(N(c1ccccc1)c1ccccc1)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)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 C31H25N5O2S2 MW 563.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H25N5O2S2/c37-26(34(21-12-4-1-5-13-21)22-14-6-2-7-15-22)20-39-31-33-32-30-35(23-16-8-3-9-17-23)28(38)27-24-18-10-11-19-25(24)40-29(27)36(30)31/h1-9,12-17H,10-11,18-20H2InChIKey
IEUODEKYJSRSQU-UHFFFAOYSA-NSynonyms
2((5oxo4phenyl456789hexahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin1yl)sulfanyl)NNdiphenylacetamide
2((5oxo4phenyl456789hexahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin1yl)thio)NNdiphenylacetamide
C1CCC2=C(C1)C3=C(S2)N4C(=NN=C4SCC(=O)N(C5=CC=CC=C5)C6=CC=CC=C6)N(C3=O)C7=CC=CC=C7
InChI=1SC31H25N5O2S2c3726(34(21124151321)22146271522)20393133323035(23168391723)28(38)27241810111925(24)4029(27)36(30)31h191217H10111820H2
MFCD03676428
ZINC000001860736
ZINC01860736
ZINC1860736
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