Vitas-M small molecule compound
7,7-dimethyl-4-(3-methylphenyl)-1-(prop-2-en-1-ylsulfanyl)-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK608975
SMILES C=CCSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)CC(OC3)(C)C
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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 C22H22N4O2S2 MW 438.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O2S2/c1-5-9-29-21-24-23-20-25(14-8-6-7-13(2)10-14)18(27)17-15-11-22(3,4)28-12-16(15)30-19(17)26(20)21/h5-8,10H,1,9,11-12H2,2-4H3InChIKey
GKGJWSFCYIFOQV-UHFFFAOYSA-NSynonyms
371125-59-61(allylthio)77dimethyl4(mtolyl)67dihydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(9H)one
371125596
77dimethyl4(3methylphenyl)1(prop2en1ylsulfanyl)69dihydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CC1=CC(=CC=C1)N2C(=O)C3=C(N4C2=NN=C4SCC=C)SC5=C3CC(OC5)(C)C
InChI=1SC22H22N4O2S2c159292124232025(1486713(2)1014)18(27)17151122(34)281216(15)3019(17)26(20)21h5810H191112H224H3
MFCD03007965
ZINC000002314003
ZINC02314003
ZINC2314003
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