Vitas-M small molecule compound
12-(4-methoxyphenyl)-9,9-dimethyl-2-(thiophen-2-yl)-8,9,10,12-tetrahydro-11H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-11-one
Catalog ID
STK270605
SMILES COc1ccc(cc1)C1C2=C(Oc3c1c1nc(nn1cn3)c1cccs1)CC(CC2=O)(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 C25H22N4O3S MW 458.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N4O3S/c1-25(2)11-16(30)20-17(12-25)32-24-21(19(20)14-6-8-15(31-3)9-7-14)23-27-22(18-5-4-10-33-18)28-29(23)13-26-24/h4-10,13,19H,11-12H2,1-3H3InChIKey
MNUXYGRNEVUYMT-UHFFFAOYSA-NSynonyms
845801-89-012(4methoxyphenyl)99dimethyl2(thiophen2yl)891012tetrahydro11Hchromeno(32e)(124)triazolo(15c)pyrimidin11one
12(4methoxyphenyl)99dimethyl2(thiophen2yl)910dihydro8Hchromeno(32e)(124)triazolo(15c)pyrimidin11(12H)one
845801890
CC1(CC2=C(C(C3=C(O2)N=CN4C3=NC(=N4)C5=CC=CS5)C6=CC=C(C=C6)OC)C(=O)C1)C
InChI=1SC25H22N4O3Sc125(2)1116(30)2017(1225)322421(19(20)146815(313)9714)232722(1854103318)2829(23)132624h4101319H1112H213H3
MFCD04170536
ZINC000002418118
ZINC000002418119
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