Vitas-M small molecule compound
8-(butylsulfanyl)-2,2-dimethyl-5-(propan-2-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Catalog ID
STK721280
SMILES CCCCSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)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 C21H27N3OS2 MW 401.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3OS2/c1-6-7-8-26-20-18-17(22-11-23-20)15-13-9-21(4,5)25-10-14(13)16(12(2)3)24-19(15)27-18/h11-12H,6-10H2,1-5H3InChIKey
BMMNGFWQFMBEOQ-UHFFFAOYSA-NSynonyms
671761-75-4671761754
8(butylsulfanyl)22dimethyl5(propan2yl)14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidine
8(butylthio)5isopropyl22dimethyl24dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidine
CCCCSC1=NC=NC2=C1SC3=NC(=C4COC(CC4=C23)(C)C)C(C)C
InChI=1SC21H27N3OS2c167826201817(22112320)1513921(45)251014(13)16(12(2)3)2419(15)2718h1112H610H215H3
MFCD02242214
ZINC000001744066
ZINC01744066
ZINC1744066
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