Vitas-M small molecule compound
{7-[4-(difluoromethoxy)-3-methoxyphenyl]-5-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}(thiophen-2-yl)methanone
Catalog ID
STL177997
SMILES COc1cc(ccc1OC(F)F)C1C(=C(Nc2n1ncn2)C(F)(F)F)C(=O)c1cccs1
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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 C19H13F5N4O3S MW 472.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13F5N4O3S/c1-30-11-7-9(4-5-10(11)31-17(20)21)14-13(15(29)12-3-2-6-32-12)16(19(22,23)24)27-18-25-8-26-28(14)18/h2-8,14,17H,1H3,(H,25,26,27)InChIKey
VNCIPLHVTZUDRT-UHFFFAOYSA-NSynonyms
832140-75-7(7(4(difluoromethoxy)3methoxyphenyl)5(trifluoromethyl)17dihydro(124)triazolo(15a)pyrimidin6yl)thiophen2ylmethanone
(7(4(difluoromethoxy)3methoxyphenyl)5(trifluoromethyl)47dihydro(124)triazolo(15a)pyrimidin6yl)(thiophen2yl)methanone
832140757
COC1=C(C=CC(=C1)C2C(=C(N=C3N2NC=N3)C(F)(F)F)C(=O)C4=CC=CS4)OC(F)F
InChI=1SC19H13F5N4O3Sc1301179(4510(11)3117(20)21)1413(15(29)123263212)16(19(2223)24)27182582628(14)18h281417H1H3(H252627)
MFCD04136497
ZINC000002806870
ZINC000020613936
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