Vitas-M small molecule compound
3-benzyl-8-ethyl-2-hydroxy-8-methyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Catalog ID
STK620511
SMILES CCC1(C)OCc2c(C1)nc1c(c2)c2c(s1)c(=O)n(c(n2)O)Cc1ccccc1
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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 C22H21N3O3S MW 407.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O3S/c1-3-22(2)10-16-14(12-28-22)9-15-17-18(29-19(15)23-16)20(26)25(21(27)24-17)11-13-7-5-4-6-8-13/h4-9H,3,10-12H2,1-2H3,(H,24,27)InChIKey
NYNBUUHICQYHMS-UHFFFAOYSA-NSynonyms
929970-28-53benzyl8ethyl2hydroxy8methyl710dihydro8Hpyrano(3456)pyrido(3245)thieno(32d)pyrimidin4(3H)one
929970285
CCC1(CC2=C(CO1)C=C3C4=C(C(=O)N(C(=O)N4)CC5=CC=CC=C5)SC3=N2)C
InChI=1SC22H21N3O3Sc1322(2)101614(122822)9151718(2919(15)2316)20(26)25(21(27)2417)11137546813h49H31012H212H3(H2427)
MFCD09788728
ZINC000013548379
ZINC000013548381
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