Vitas-M small molecule compound
6-methyl-1-[(2-methylprop-2-en-1-yl)sulfanyl]-4-phenyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK720924
SMILES CC(=C)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)C(C)CCC3
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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 C22H22N4OS2 MW 422.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4OS2/c1-13(2)12-28-22-24-23-21-25(15-9-5-4-6-10-15)19(27)18-17-14(3)8-7-11-16(17)29-20(18)26(21)22/h4-6,9-10,14H,1,7-8,11-12H2,2-3H3InChIKey
QKEOWHHWYVDZFG-UHFFFAOYSA-NSynonyms
6methyl1((2methylallyl)thio)4phenyl6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
6methyl1((2methylprop2en1yl)sulfanyl)4phenyl6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CC1CCCC2=C1C3=C(S2)N4C(=NN=C4SCC(=C)C)N(C3=O)C5=CC=CC=C5
InChI=1SC22H22N4OS2c113(2)12282224232125(1595461015)19(27)181714(3)871116(17)2920(18)26(21)22h4691014H1781112H223H3
MFCD02234135
ZINC000000985805
ZINC000000985806
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