Vitas-M small molecule compound
2-({5-[(3-ethyl-5-methylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-phenylethyl)acetamide
Catalog ID
STK736285
SMILES CCc1cc(OCc2nnc(n2c2ccccc2)SCC(=O)NCCc2ccccc2)cc(c1)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 C28H30N4O2S MW 486.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N4O2S/c1-3-22-16-21(2)17-25(18-22)34-19-26-30-31-28(32(26)24-12-8-5-9-13-24)35-20-27(33)29-15-14-23-10-6-4-7-11-23/h4-13,16-18H,3,14-15,19-20H2,1-2H3,(H,29,33)InChIKey
AKGHJBPYXCUUMP-UHFFFAOYSA-NSynonyms
2((5((3ethyl5methylphenoxy)methyl)4phenyl124triazol3yl)sulfanyl)N(2phenylethyl)acetamide
2((5((3ETHYL5METHYLPHENOXY)METHYL)4PHENYL124TRIAZOL3YL)SULFANYL)NPHENETHYLACETAMIDE
2((5((3ethyl5methylphenoxy)methyl)4phenyl4H124triazol3yl)sulfanyl)N(2phenylethyl)acetamide
CCC1=CC(=CC(=C1)C)OCC2=NN=C(N2C3=CC=CC=C3)SCC(=O)NCCC4=CC=CC=C4
InChI=1SC28H30N4O2Sc13221621(2)1725(1822)341926303128(32(26)24128591324)352027(33)29151423106471123h4131618H314151920H212H3(H2933)
MFCD07021996
ZINC000012413196
ZINC12413196
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