Vitas-M small molecule compound
N-(2,4-dimethoxyphenyl)-7-{4-[(4-fluorobenzyl)oxy]-3-methoxyphenyl}-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Catalog ID
STK184983
SMILES COc1cc(ccc1OCc1ccc(cc1)F)C1C(=C(C)Nc2n1ncn2)C(=O)Nc1ccc(cc1OC)OC
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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 C29H28FN5O5 MW 545.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28FN5O5/c1-17-26(28(36)34-22-11-10-21(37-2)14-24(22)38-3)27(35-29(33-17)31-16-32-35)19-7-12-23(25(13-19)39-4)40-15-18-5-8-20(30)9-6-18/h5-14,16,27H,15H2,1-4H3,(H,34,36)(H,31,32,33)InChIKey
JSXFGILCEDXCNS-UHFFFAOYSA-NSynonyms
CC1=C(C(N2C(=N1)N=CN2)C3=CC(=C(C=C3)OCC4=CC=C(C=C4)F)OC)C(=O)NC5=C(C=C(C=C5)OC)OC
InChI=1SC29H28FN5O5c11726(28(36)3422111021(372)1424(22)383)27(3529(3317)31163235)1971223(25(1319)394)4015185820(30)9618h5141627H15H214H3(H3436)(H313233)
MFCD06092949
N(24DIMETHOXYPHENYL)7(4((4FLUOROBENZYL)OXY)3METHOXYPHENYL)5METHYL47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXAMIDE
N(24dimethoxyphenyl)7(4((4fluorophenyl)methoxy)3methoxyphenyl)5methyl17dihydro(124)triazolo(15a)pyrimidine6carboxamide
ZINC000098043028
ZINC000098043029
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