Vitas-M small molecule compound
4-(heptyloxy)-8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Catalog ID
STK531847
SMILES CCCCCCCOc1ncnc2c1sc1c2cc2c(n1)CC(OC2)(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 C21H27N3O2S MW 385.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O2S/c1-4-5-6-7-8-9-25-19-18-17(22-13-23-19)15-10-14-12-26-21(2,3)11-16(14)24-20(15)27-18/h10,13H,4-9,11-12H2,1-3H3InChIKey
CJGLKEOMQKUWPA-UHFFFAOYSA-NSynonyms
4(heptyloxy)88dimethyl710dihydro8Hpyrano(3456)pyrido(3245)thieno(32d)pyrimidine
4(heptyloxy)88dimethyl810dihydro7Hpyrano(3456)pyrido(3245)thieno(32d)pyrimidine
CCCCCCCOC1=NC=NC2=C1SC3=NC4=C(COC(C4)(C)C)C=C23
InChI=1SC21H27N3O2Sc145678925191817(22132319)151014122621(23)1116(14)2420(15)2718h1013H491112H213H3
MFCD02991512
ZINC000097951122
ZINC97951122
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