Vitas-M small molecule compound
4-benzyl-1-(hexylsulfanyl)-7-(propan-2-yl)-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
STK539098
SMILES CCCCCCSc1nnc2n1c1sc3c(c1c(=O)n2Cc1ccccc1)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 C26H32N4O2S2 MW 496.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32N4O2S2/c1-4-5-6-10-13-33-26-28-27-25-29(15-18-11-8-7-9-12-18)23(31)22-19-14-20(17(2)3)32-16-21(19)34-24(22)30(25)26/h7-9,11-12,17,20H,4-6,10,13-16H2,1-3H3InChIKey
XOZPHDVNWMZPLR-UHFFFAOYSA-NSynonyms
384795-48-6384795486
4benzyl1(hexylsulfanyl)7(propan2yl)69dihydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
4benzyl1(hexylthio)7isopropyl67dihydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(9H)one
CCCCCCSC1=NN=C2N1C3=C(C4=C(S3)COC(C4)C(C)C)C(=O)N2CC5=CC=CC=C5
InChI=1SC26H32N4O2S2c14561013332628272529(1518118791218)23(31)22191420(17(2)3)321621(19)3424(22)30(25)26h7911121720H46101316H213H3
MFCD03284306
ZINC000001902242
ZINC000001902243
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