Vitas-M small molecule compound
2-({5-[(4-tert-butylphenoxy)methyl]-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,6-dichlorophenyl)acetamide
Catalog ID
STK680601
SMILES O=C(Nc1c(Cl)cccc1Cl)CSc1nnc(n1c1ccccc1C)COc1ccc(cc1)C(C)(C)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 C28H28Cl2N4O2S MW 555.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28Cl2N4O2S/c1-18-8-5-6-11-23(18)34-24(16-36-20-14-12-19(13-15-20)28(2,3)4)32-33-27(34)37-17-25(35)31-26-21(29)9-7-10-22(26)30/h5-15H,16-17H2,1-4H3,(H,31,35)InChIKey
RPFGFTBJBUHWDA-UHFFFAOYSA-NSynonyms
539808-79-22((5((4(TERTBUTYL)PHENOXY)METHYL)4(OTOLYL)4H124TRIAZOL3YL)THIO)N(26DICHLOROPHENYL)ACETAMIDE
2((5((4TERTBUTYLPHENOXY)METHYL)4(2METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N(26DICHLOROPHENYL)ACETAMIDE
2((5((4tertbutylphenoxy)methyl)4(2methylphenyl)4H124triazol3yl)sulfanyl)N(26dichlorophenyl)acetamide
539808792
CC1=CC=CC=C1N2C(=NN=C2SCC(=O)NC3=C(C=CC=C3Cl)Cl)COC4=CC=C(C=C4)C(C)(C)C
InChI=1SC28H28Cl2N4O2Sc1188561123(18)3424(163620141219(131520)28(23)4)323327(34)371725(35)312621(29)971022(26)30h515H1617H214H3(H3135)
MFCD03460704
ZINC000002507669
ZINC2507669
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