Vitas-M small molecule compound
1-{5-[2-(benzyloxy)phenyl]-4-(3,4-dimethylphenyl)-1-phenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl}ethanone
Catalog ID
STK510722
SMILES CC(=O)C1=NN(C(N1c1ccc(c(c1)C)C)c1ccccc1OCc1ccccc1)c1ccccc1
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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 C31H29N3O2 MW 475.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29N3O2/c1-22-18-19-27(20-23(22)2)33-30(24(3)35)32-34(26-14-8-5-9-15-26)31(33)28-16-10-11-17-29(28)36-21-25-12-6-4-7-13-25/h4-20,31H,21H2,1-3H3InChIKey
NQQYGCNESQJJPX-UHFFFAOYSA-NSynonyms
1(4(34DIMETHYLPHENYL)2PHENYL3(2PHENYLMETHOXYPHENYL)3H124TRIAZOL5YL)ETHANONE
1(5(2(benzyloxy)phenyl)4(34dimethylphenyl)1phenyl45dihydro1H124triazol3yl)ethanone
CC1=C(C=C(C=C1)N2C(N(N=C2C(=O)C)C3=CC=CC=C3)C4=CC=CC=C4OCC5=CC=CC=C5)C
InChI=1SC31H29N3O2c122181927(2023(22)2)3330(24(3)35)3234(26148591526)31(33)281610111729(28)362125126471325h42031H21H213H3
MFCD02182294
ZINC000016312324
ZINC000016312327
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