Vitas-M small molecule compound
7-{4-[(4-fluorobenzyl)oxy]-3-methoxyphenyl}-5-methyl-N-(2-methylphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Catalog ID
STK199586
SMILES COc1cc(ccc1OCc1ccc(cc1)F)C1C(=C(C)Nc2n1ncn2)C(=O)Nc1ccccc1C
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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 C28H26FN5O3 MW 499.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26FN5O3/c1-17-6-4-5-7-22(17)33-27(35)25-18(2)32-28-30-16-31-34(28)26(25)20-10-13-23(24(14-20)36-3)37-15-19-8-11-21(29)12-9-19/h4-14,16,26H,15H2,1-3H3,(H,33,35)(H,30,31,32)InChIKey
KKXBHLRWYOMSGH-UHFFFAOYSA-NSynonyms
7(4((4FLUOROBENZYL)OXY)3METHOXYPHENYL)5METHYLN(2METHYLPHENYL)47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXAMIDE
7(4((4fluorophenyl)methoxy)3methoxyphenyl)5methylN(2methylphenyl)17dihydro(124)triazolo(15a)pyrimidine6carboxamide
CC1=CC=CC=C1NC(=O)C2=C(N=C3N=CNN3C2C4=CC(=C(C=C4)OCC5=CC=C(C=C5)F)OC)C
InChI=1SC28H26FN5O3c117645722(17)3327(35)2518(2)322830163134(28)26(25)20101323(24(1420)363)37151981121(29)12919h4141626H15H213H3(H3335)(H303132)
MFCD06757388
ZINC000009934740
ZINC000009934741
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