Vitas-M small molecule compound
N-(2-methoxyphenyl)-7-(4-methoxyphenyl)-5-methyl-2-(methylsulfanyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Catalog ID
STK591535
SMILES COc1ccc(cc1)C1C(=C(C)N=c2n1nc([nH]2)SC)C(=O)Nc1ccccc1OC
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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 C22H23N5O3S MW 437.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5O3S/c1-13-18(20(28)24-16-7-5-6-8-17(16)30-3)19(14-9-11-15(29-2)12-10-14)27-21(23-13)25-22(26-27)31-4/h5-12,19H,1-4H3,(H,24,28)(H,23,25,26)InChIKey
BEJSRJXRUAQJJK-UHFFFAOYSA-NSynonyms
898795-61-4898795614
CC1=C(C(N2C(=N1)N=C(N2)SC)C3=CC=C(C=C3)OC)C(=O)NC4=CC=CC=C4OC
COc1ccc(cc1)C1C(=C(C)N=c2n1nc((nH)2)SC)C(=O)Nc1ccccc1OC
InChI=1SC22H23N5O3Sc11318(20(28)2416756817(16)303)19(1491115(292)121014)2721(2313)2522(2627)314h51219H14H3(H2428)(H232526)
MFCD08733131
N(2methoxyphenyl)7(4methoxyphenyl)5methyl2(methylsulfanyl)37dihydro(124)triazolo(15a)pyrimidine6carboxamide
N(2methoxyphenyl)7(4methoxyphenyl)5methyl2methylsulfanyl17dihydro(124)triazolo(15a)pyrimidine6carboxamide
ZINC000009942448
ZINC000009942452
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