Vitas-M small molecule compound
N-benzyl-7-{2-[(4-chlorobenzyl)oxy]-3-methoxyphenyl}-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Catalog ID
STK199607
SMILES COc1cccc(c1OCc1ccc(cc1)Cl)C1C(=C(C)Nc2n1ncn2)C(=O)NCc1ccccc1
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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 C28H26ClN5O3 MW 516.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26ClN5O3/c1-18-24(27(35)30-15-19-7-4-3-5-8-19)25(34-28(33-18)31-17-32-34)22-9-6-10-23(36-2)26(22)37-16-20-11-13-21(29)14-12-20/h3-14,17,25H,15-16H2,1-2H3,(H,30,35)(H,31,32,33)InChIKey
ORKBAOGBJQDWKM-UHFFFAOYSA-NSynonyms
CC1=C(C(N2C(=N1)N=CN2)C3=C(C(=CC=C3)OC)OCC4=CC=C(C=C4)Cl)C(=O)NCC5=CC=CC=C5
InChI=1SC28H26ClN5O3c11824(27(35)3015197435819)25(3428(3318)31173234)22961023(362)26(22)371620111321(29)141220h3141725H1516H212H3(H3035)(H313233)
MFCD06757532
NBENZYL7(2((4CHLOROBENZYL)OXY)3METHOXYPHENYL)5METHYL47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXAMIDE
Nbenzyl7(2((4chlorophenyl)methoxy)3methoxyphenyl)5methyl17dihydro(124)triazolo(15a)pyrimidine6carboxamide
ZINC000009934756
ZINC000009934757
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