Vitas-M small molecule compound
2-bromo-N-(4-{4-methyl-5-[(2,4,6-trimethylbenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}phenyl)benzamide
Catalog ID
STK147497
SMILES Cc1cc(C)c(c(c1)C)CSc1nnc(n1C)c1ccc(cc1)NC(=O)c1ccccc1Br
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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 C26H25BrN4OS MW 521.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25BrN4OS/c1-16-13-17(2)22(18(3)14-16)15-33-26-30-29-24(31(26)4)19-9-11-20(12-10-19)28-25(32)21-7-5-6-8-23(21)27/h5-14H,15H2,1-4H3,(H,28,32)InChIKey
QFHJSINUDALOSY-UHFFFAOYSA-NSynonyms
2BROMON(4(4METHYL5((246TRIMETHYLBENZYL)SULFANYL)4H124TRIAZOL3YL)PHENYL)BENZAMIDE
2BROMON(4(4METHYL5((246TRIMETHYLPHENYL)METHYLSULFANYL)124TRIAZOL3YL)PHENYL)BENZAMIDE
2BROMON(4(5((MESITYLMETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)PHENYL)BENZAMIDE
CC1=CC(=C(C(=C1)C)CSC2=NN=C(N2C)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4Br)C
InChI=1SC26H25BrN4OSc1161317(2)22(18(3)1416)153326302924(31(26)4)1991120(121019)2825(32)21756823(21)27h514H15H214H3(H2832)
MFCD04153214
ZINC000008438229
ZINC08438229
ZINC8438229
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