Vitas-M small molecule compound
N-(4-chloro-2,5-dimethoxyphenyl)-7-{3-ethoxy-4-[(2-fluorobenzyl)oxy]phenyl}-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Catalog ID
STK185040
SMILES CCOc1cc(ccc1OCc1ccccc1F)C1C(=C(C)Nc2n1ncn2)C(=O)Nc1cc(OC)c(cc1OC)Cl
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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 C30H29ClFN5O5 MW 594.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29ClFN5O5/c1-5-41-26-12-18(10-11-23(26)42-15-19-8-6-7-9-21(19)32)28-27(17(2)35-30-33-16-34-37(28)30)29(38)36-22-14-24(39-3)20(31)13-25(22)40-4/h6-14,16,28H,5,15H2,1-4H3,(H,36,38)(H,33,34,35)InChIKey
OPGAWUALLHJZMF-UHFFFAOYSA-NSynonyms
CCOC1=C(C=CC(=C1)C2C(=C(N=C3N2NC=N3)C)C(=O)NC4=CC(=C(C=C4OC)Cl)OC)OCC5=CC=CC=C5F
InChI=1SC30H29ClFN5O5c1541261218(101123(26)421519867921(19)32)2827(17(2)353033163437(28)30)29(38)36221424(393)20(31)1325(22)404h6141628H515H214H3(H3638)(H333435)
MFCD06150958
N(4CHLORO25DIMETHOXYPHENYL)7(3ETHOXY4((2FLUOROBENZYL)OXY)PHENYL)5METHYL47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXAMIDE
N(4chloro25dimethoxyphenyl)7(3ethoxy4((2fluorophenyl)methoxy)phenyl)5methyl17dihydro(124)triazolo(15a)pyrimidine6carboxamide
ZINC000098043106
ZINC000098043107
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