Vitas-M small molecule compound
10,10-dimethyl-6-(2-methylprop-2-en-1-yl)-2-(pyridin-3-yl)-6,8,10,11-tetrahydro-5H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-one
Catalog ID
STK633074
SMILES CC(=C)Cn1c(=O)n2nc(nc2c2c1sc1c2CC(OC1)(C)C)c1cccnc1
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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 C21H21N5O2S MW 407.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O2S/c1-12(2)10-25-19-16(14-8-21(3,4)28-11-15(14)29-19)18-23-17(24-26(18)20(25)27)13-6-5-7-22-9-13/h5-7,9H,1,8,10-11H2,2-4H3InChIKey
MGHAGUVQGVREBP-UHFFFAOYSA-NSynonyms
951939-19-81010dimethyl6(2methylallyl)2(pyridin3yl)681011tetrahydro5Hpyrano(4345)thieno(32e)(124)triazolo(15c)pyrimidin5one
1010dimethyl6(2methylprop2en1yl)2(pyridin3yl)681011tetrahydro5Hpyrano(4345)thieno(32e)(124)triazolo(15c)pyrimidin5one
951939198
CC(=C)CN1C2=C(C3=C(S2)COC(C3)(C)C)C4=NC(=NN4C1=O)C5=CN=CC=C5
InChI=1SC21H21N5O2Sc112(2)10251916(14821(34)281115(14)2919)182317(2426(18)20(25)27)1365722913h579H181011H224H3
MFCD09856717
ZINC000013727531
ZINC13727531
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