Vitas-M small molecule compound
4-(3-methylphenyl)-7-(propan-2-yl)-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
STK539273
SMILES C=CCSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)CC(OC3)C(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 C23H24N4O2S2 MW 452.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N4O2S2/c1-5-9-30-23-25-24-22-26(15-8-6-7-14(4)10-15)20(28)19-16-11-17(13(2)3)29-12-18(16)31-21(19)27(22)23/h5-8,10,13,17H,1,9,11-12H2,2-4H3InChIKey
RQMNHJUZNIKSNP-UHFFFAOYSA-NSynonyms
370871-03-71(allylthio)7isopropyl4(mtolyl)67dihydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(9H)one
370871037
4(3methylphenyl)7(propan2yl)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)C
InChI=1SC23H24N4O2S2c159302325242226(1586714(4)1015)20(28)19161117(13(2)3)291218(16)3121(19)27(22)23h58101317H191112H224H3
MFCD03010658
ZINC000001831009
ZINC000001831010
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