Vitas-M small molecule compound
2-({5-[(4-tert-butylphenoxy)methyl]-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,6-dichlorophenyl)acetamide
Catalog ID
STL186071
SMILES Cc1cccc(c1)n1c(COc2ccc(cc2)C(C)(C)C)nnc1SCC(=O)Nc1c(Cl)cccc1Cl
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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 C28H28Cl2N4O2S MW 555.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28Cl2N4O2S/c1-18-7-5-8-20(15-18)34-24(16-36-21-13-11-19(12-14-21)28(2,3)4)32-33-27(34)37-17-25(35)31-26-22(29)9-6-10-23(26)30/h5-15H,16-17H2,1-4H3,(H,31,35)InChIKey
MTPZJTGJBISFOB-UHFFFAOYSA-NSynonyms
2((5((4TERTBUTYLPHENOXY)METHYL)4(3METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N(26DICHLOROPHENYL)ACETAMIDE
2((5((4tertbutylphenoxy)methyl)4(3methylphenyl)4H124triazol3yl)sulfanyl)N(26dichlorophenyl)acetamide
CC1=CC(=CC=C1)N2C(=NN=C2SCC(=O)NC3=C(C=CC=C3Cl)Cl)COC4=CC=C(C=C4)C(C)(C)C
InChI=1SC28H28Cl2N4O2Sc11875820(1518)3424(163621131119(121421)28(23)4)323327(34)371725(35)312622(29)961023(26)30h515H1617H214H3(H3135)
MFCD03459811
ZINC000002684251
ZINC2684251
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