Vitas-M small molecule compound
7-{4-[(2,6-dichlorobenzyl)oxy]-3-methoxyphenyl}-5-methyl-N-(2-methylphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Catalog ID
STK185071
SMILES COc1cc(ccc1OCc1c(Cl)cccc1Cl)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 C28H25Cl2N5O3 MW 550.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25Cl2N5O3/c1-16-7-4-5-10-22(16)34-27(36)25-17(2)33-28-31-15-32-35(28)26(25)18-11-12-23(24(13-18)37-3)38-14-19-20(29)8-6-9-21(19)30/h4-13,15,26H,14H2,1-3H3,(H,34,36)(H,31,32,33)InChIKey
OEGVYQJDICXKNW-UHFFFAOYSA-NSynonyms
7(4((26DICHLOROBENZYL)OXY)3METHOXYPHENYL)5METHYLN(2METHYLPHENYL)47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXAMIDE
7(4((26dichlorophenyl)methoxy)3methoxyphenyl)5methylN(2methylphenyl)17dihydro(124)triazolo(15a)pyrimidine6carboxamide
CC1=CC=CC=C1NC(=O)C2=C(N=C3N=CNN3C2C4=CC(=C(C=C4)OCC5=C(C=CC=C5Cl)Cl)OC)C
InChI=1SC28H25Cl2N5O3c1167451022(16)3427(36)2517(2)332831153235(28)26(25)18111223(24(1318)373)38141920(29)86921(19)30h4131526H14H213H3(H3436)(H313233)
MFCD06757396
ZINC000098043533
ZINC000098043534
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