Vitas-M small molecule compound
2-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-6-(propan-2-yl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine
Catalog ID
STK844559
SMILES CC(C1OCc2c(C1)c1c(N)nc(nc1s2)SC/C=C/c1ccccc1)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 C21H23N3OS2 MW 397.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3OS2/c1-13(2)16-11-15-17(12-25-16)27-20-18(15)19(22)23-21(24-20)26-10-6-9-14-7-4-3-5-8-14/h3-9,13,16H,10-12H2,1-2H3,(H2,22,23,24)/b9-6+InChIKey
HCGYCTGQSXLEHQ-RMKNXTFCSA-NSynonyms
799783-38-32(((2E)3phenylprop2en1yl)sulfanyl)6(propan2yl)58dihydro6Hpyrano(4345)thieno(23d)pyrimidin4amine
2((E)3phenylprop2enyl)sulfanyl6propan2yl68dihydro5Hpyrano(45)thieno(12c)pyrimidin4amine
2(cinnamylthio)6isopropyl68dihydro5Hpyrano(4345)thieno(23d)pyrimidin4amine
799783383
CC(C)C1CC2=C(CO1)SC3=NC(=NC(=C23)N)SCC=CC4=CC=CC=C4
CC(C1OCc2c(C1)c1c(N)nc(nc1s2)SCC=Cc1ccccc1)C
InChI=1SC21H23N3OS2c113(2)16111517(122516)272018(15)19(22)2321(2420)261069147435814h391316H1012H212H3(H2222324)b96+
MFCD03674704
ZINC000002213484
ZINC000002213487
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