Vitas-M small molecule compound
7-{4-[(3,4-dichlorobenzyl)oxy]-3-methoxyphenyl}-N-(2-methoxyphenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Catalog ID
STK185089
SMILES COc1cc(ccc1OCc1ccc(c(c1)Cl)Cl)C1C(=C(C)Nc2n1ncn2)C(=O)Nc1ccccc1OC
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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 C28H25Cl2N5O4 MW 566.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25Cl2N5O4/c1-16-25(27(36)34-21-6-4-5-7-22(21)37-2)26(35-28(33-16)31-15-32-35)18-9-11-23(24(13-18)38-3)39-14-17-8-10-19(29)20(30)12-17/h4-13,15,26H,14H2,1-3H3,(H,34,36)(H,31,32,33)InChIKey
NXNRILBYWLJZGL-UHFFFAOYSA-NSynonyms
7(4((34DICHLOROBENZYL)OXY)3METHOXYPHENYL)N(2METHOXYPHENYL)5METHYL47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXAMIDE
7(4((34dichlorophenyl)methoxy)3methoxyphenyl)N(2methoxyphenyl)5methyl17dihydro(124)triazolo(15a)pyrimidine6carboxamide
CC1=C(C(N2C(=N1)N=CN2)C3=CC(=C(C=C3)OCC4=CC(=C(C=C4)Cl)Cl)OC)C(=O)NC5=CC=CC=C5OC
InChI=1SC28H25Cl2N5O4c11625(27(36)3421645722(21)372)26(3528(3316)31153235)1891123(24(1318)383)39141781019(29)20(30)1217h4131526H14H213H3(H3436)(H313233)
MFCD06757429
ZINC000098043537
ZINC000098043538
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