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-(1-phenylpropan-2-yl)acetamide
Catalog ID
STK551897
SMILES O=C(NC(Cc1ccccc1)C)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 C28H27N5O2S2 MW 529.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N5O2S2/c1-18(16-19-10-4-2-5-11-19)29-23(34)17-36-28-31-30-27-32(20-12-6-3-7-13-20)25(35)24-21-14-8-9-15-22(21)37-26(24)33(27)28/h2-7,10-13,18H,8-9,14-17H2,1H3,(H,29,34)InChIKey
AKCNGXJTVVIJBV-UHFFFAOYSA-NSynonyms
836634-32-32((5oxo4phenyl456789hexahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin1yl)sulfanyl)N(1phenylpropan2yl)acetamide
2((5oxo4phenyl456789hexahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin1yl)thio)N(1phenylpropan2yl)acetamide
836634323
CC(CC1=CC=CC=C1)NC(=O)CSC2=NN=C3N2C4=C(C5=C(S4)CCCC5)C(=O)N3C6=CC=CC=C6
InChI=1SC28H27N5O2S2c118(1619104251119)2923(34)17362831302732(20126371320)25(35)242114891522(21)3726(24)33(27)28h27101318H891417H21H3(H2934)
MFCD03689437
ZINC000097952361
ZINC000097952362
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