Vitas-M small molecule compound
3-hexyl-2,8,8-trimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Catalog ID
STK831787
SMILES CCCCCCn1c(C)nc2c(c1=O)sc1c2cc2c(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/c1-5-6-7-8-9-24-13(2)22-17-15-10-14-12-26-21(3,4)11-16(14)23-19(15)27-18(17)20(24)25/h10H,5-9,11-12H2,1-4H3InChIKey
LMECKKXNTSTHSI-UHFFFAOYSA-NSynonyms
383903-26-2383903262
3hexyl288trimethyl710dihydro8Hpyrano(3456)pyrido(3245)thieno(32d)pyrimidin4(3H)one
3hexyl288trimethyl78dihydro3Hpyrano(3456)pyrido(3245)thieno(32d)pyrimidin4(10H)one
CCCCCCN1C(=NC2=C(C1=O)SC3=NC4=C(COC(C4)(C)C)C=C23)C
InChI=1SC21H27N3O2Sc1567892413(2)2217151014122621(34)1116(14)2319(15)2718(17)20(24)25h10H591112H214H3
MFCD03283963
ZINC000001823545
ZINC01823545
ZINC1823545
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