Vitas-M small molecule compound
4-(4-chlorophenyl)-7-methyl-1-[(2-oxo-2-phenylethyl)sulfanyl]-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK555564
SMILES CC1CCc2c(C1)c1c(s2)n2c(SCC(=O)c3ccccc3)nnc2n(c1=O)c1ccc(cc1)Cl
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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 C26H21ClN4O2S2 MW 521.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21ClN4O2S2/c1-15-7-12-21-19(13-15)22-23(33)30(18-10-8-17(27)9-11-18)25-28-29-26(31(25)24(22)35-21)34-14-20(32)16-5-3-2-4-6-16/h2-6,8-11,15H,7,12-14H2,1H3InChIKey
STMARRUASXKFCU-UHFFFAOYSA-NSynonyms
842955-34-44(4chlorophenyl)7methyl1((2oxo2phenylethyl)sulfanyl)6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
4(4chlorophenyl)7methyl1((2oxo2phenylethyl)thio)6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
842955344
CC1CCC2=C(C1)C3=C(S2)N4C(=NN=C4SCC(=O)C5=CC=CC=C5)N(C3=O)C6=CC=C(C=C6)Cl
InChI=1SC26H21ClN4O2S2c1157122119(1315)2223(33)30(1810817(27)91118)25282926(31(25)24(22)3521)341420(32)165324616h2681115H71214H21H3
MFCD04012088
ZINC000002397367
ZINC000002397368
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