Vitas-M small molecule compound
7-{3-[(4-fluorobenzyl)oxy]phenyl}-N-(2-methoxyphenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Catalog ID
STK199592
SMILES COc1ccccc1NC(=O)C1=C(C)Nc2n(C1c1cccc(c1)OCc1ccc(cc1)F)ncn2
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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 C27H24FN5O3 MW 485.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24FN5O3/c1-17-24(26(34)32-22-8-3-4-9-23(22)35-2)25(33-27(31-17)29-16-30-33)19-6-5-7-21(14-19)36-15-18-10-12-20(28)13-11-18/h3-14,16,25H,15H2,1-2H3,(H,32,34)(H,29,30,31)InChIKey
RMRAUQJJOGFSKH-UHFFFAOYSA-NSynonyms
7(3((4FLUOROBENZYL)OXY)PHENYL)N(2METHOXYPHENYL)5METHYL47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXAMIDE
7(3((4fluorophenyl)methoxy)phenyl)N(2methoxyphenyl)5methyl17dihydro(124)triazolo(15a)pyrimidine6carboxamide
CC1=C(C(N2C(=N1)N=CN2)C3=CC(=CC=C3)OCC4=CC=C(C=C4)F)C(=O)NC5=CC=CC=C5OC
InChI=1SC27H24FN5O3c11724(26(34)3222834923(22)352)25(3327(3117)29163033)1965721(1419)361518101220(28)131118h3141625H15H212H3(H3234)(H293031)
MFCD06757439
ZINC000009934750
ZINC000009934751
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