Vitas-M small molecule compound
1-{5-[2-(benzyloxy)-3-methoxyphenyl]-4-(3,4-dimethylphenyl)-1-phenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl}ethanone
Catalog ID
STK744169
SMILES COc1cccc(c1OCc1ccccc1)C1N(N=C(N1c1ccc(c(c1)C)C)C(=O)C)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 C32H31N3O3 MW 505.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H31N3O3/c1-22-18-19-27(20-23(22)2)34-31(24(3)36)33-35(26-14-9-6-10-15-26)32(34)28-16-11-17-29(37-4)30(28)38-21-25-12-7-5-8-13-25/h5-20,32H,21H2,1-4H3InChIKey
MOJYUEHNYLIIDI-UHFFFAOYSA-NSynonyms
1(4(34DIMETHYLPHENYL)3(3METHOXY2PHENYLMETHOXYPHENYL)2PHENYL3H124TRIAZOL5YL)ETHANONE
1(5(2(benzyloxy)3methoxyphenyl)4(34dimethylphenyl)1phenyl45dihydro1H124triazol3yl)ethanone
CC1=C(C=C(C=C1)N2C(N(N=C2C(=O)C)C3=CC=CC=C3)C4=C(C(=CC=C4)OC)OCC5=CC=CC=C5)C
InChI=1SC32H31N3O3c122181927(2023(22)2)3431(24(3)36)3335(261496101526)32(34)2816111729(374)30(28)382125127581325h52032H21H214H3
MFCD02182297
ZINC000002137920
ZINC000002137922
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