Vitas-M small molecule compound
N-(2,5-dimethoxyphenyl)-7-{3-ethoxy-4-[(4-methylbenzyl)oxy]phenyl}-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Catalog ID
STK185031
SMILES CCOc1cc(ccc1OCc1ccc(cc1)C)C1C(=C(C)Nc2n1ncn2)C(=O)Nc1cc(OC)ccc1OC
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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 C31H33N5O5 MW 555.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H33N5O5/c1-6-40-27-15-22(11-13-26(27)41-17-21-9-7-19(2)8-10-21)29-28(20(3)34-31-32-18-33-36(29)31)30(37)35-24-16-23(38-4)12-14-25(24)39-5/h7-16,18,29H,6,17H2,1-5H3,(H,35,37)(H,32,33,34)InChIKey
MTOBZJMFVATVFB-UHFFFAOYSA-NSynonyms
CCOC1=C(C=CC(=C1)C2C(=C(N=C3N2NC=N3)C)C(=O)NC4=C(C=CC(=C4)OC)OC)OCC5=CC=C(C=C5)C
InChI=1SC31H33N5O5c1640271522(111326(27)4117219719(2)81021)2928(20(3)343132183336(29)31)30(37)35241623(384)121425(24)395h7161829H617H215H3(H3537)(H323334)
MFCD06150838
N(25DIMETHOXYPHENYL)7(3ETHOXY4((4METHYLBENZYL)OXY)PHENYL)5METHYL47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXAMIDE
N(25dimethoxyphenyl)7(3ethoxy4((4methylphenyl)methoxy)phenyl)5methyl17dihydro(124)triazolo(15a)pyrimidine6carboxamide
ZINC000098043064
ZINC000098043065
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