Vitas-M small molecule compound
7-{4-[(4-chlorobenzyl)oxy]-3-methoxyphenyl}-N-(2-methoxyphenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Catalog ID
STK185084
SMILES COc1cc(ccc1OCc1ccc(cc1)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 C28H26ClN5O4 MW 532.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26ClN5O4/c1-17-25(27(35)33-21-6-4-5-7-22(21)36-2)26(34-28(32-17)30-16-31-34)19-10-13-23(24(14-19)37-3)38-15-18-8-11-20(29)12-9-18/h4-14,16,26H,15H2,1-3H3,(H,33,35)(H,30,31,32)InChIKey
JHEHFIPBKIHRHD-UHFFFAOYSA-NSynonyms
7(4((4CHLOROBENZYL)OXY)3METHOXYPHENYL)N(2METHOXYPHENYL)5METHYL47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXAMIDE
7(4((4chlorophenyl)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)OC)C(=O)NC5=CC=CC=C5OC
InChI=1SC28H26ClN5O4c11725(27(35)3321645722(21)362)26(3428(3217)30163134)19101323(24(1419)373)38151881120(29)12918h4141626H15H213H3(H3335)(H303132)
MFCD06757420
ZINC000098043240
ZINC000098043241
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