Vitas-M small molecule compound
1-(biphenyl-4-yl)-2-({5-[(4-methylphenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)ethanone
Catalog ID
STK579188
SMILES C=CCn1c(SCC(=O)c2ccc(cc2)c2ccccc2)nnc1COc1ccc(cc1)C
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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 C27H25N3O2S MW 455.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N3O2S/c1-3-17-30-26(18-32-24-15-9-20(2)10-16-24)28-29-27(30)33-19-25(31)23-13-11-22(12-14-23)21-7-5-4-6-8-21/h3-16H,1,17-19H2,2H3InChIKey
PFACFVKZFDAFCU-UHFFFAOYSA-NSynonyms
731797-50-51((11biphenyl)4yl)2((4allyl5((ptolyloxy)methyl)4H124triazol3yl)thio)ethanone
1(biphenyl4yl)2((5((4methylphenoxy)methyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)ethanone
2((5((4METHYLPHENOXY)METHYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)1(4PHENYLPHENYL)ETHANONE
2((5(4METHYLPHENOXYMETHYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)1(4PHENYLPHENYL)ETHAN1ONE
2(5((4METHYLPHENOXY)METHYL)4PROP2ENYL(124TRIAZOL3YLTHIO))1(4PHENYLPHENYL)ETHAN1ONE
731797505
CC1=CC=C(C=C1)OCC2=NN=C(N2CC=C)SCC(=O)C3=CC=C(C=C3)C4=CC=CC=C4
InChI=1SC27H25N3O2Sc13173026(18322415920(2)101624)282927(30)331925(31)23131122(121423)217546821h316H11719H22H3
MFCD04631903
ZINC000003295789
ZINC03295789
ZINC3295789
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