Vitas-M small molecule compound
N-(4-bromo-2-methylphenyl)-2-{[5-(4-tert-butylphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STL294026
SMILES O=C(Nc1ccc(cc1C)Br)CSc1nnc(n1C)c1ccc(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 C22H25BrN4OS MW 473.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25BrN4OS/c1-14-12-17(23)10-11-18(14)24-19(28)13-29-21-26-25-20(27(21)5)15-6-8-16(9-7-15)22(2,3)4/h6-12H,13H2,1-5H3,(H,24,28)InChIKey
OTYDVALBZBXWIY-UHFFFAOYSA-NSynonyms
849020-67-32(5(4(TERTBUTYL)PHENYL)4METHYL(124TRIAZOL3YLTHIO))N(4BROMO2METHYLPHENYL)ACETAMIDE
849020673
CC1=C(C=CC(=C1)Br)NC(=O)CSC2=NN=C(N2C)C3=CC=C(C=C3)C(C)(C)C
InChI=1SC22H25BrN4OSc1141217(23)101118(14)2419(28)132921262520(27(21)5)156816(9715)22(23)4h612H13H215H3(H2428)
MFCD05681193
N(4bromo2methylphenyl)2((5(4(tertbutyl)phenyl)4methyl4H124triazol3yl)thio)acetamide
N(4BROMO2METHYLPHENYL)2((5(4TERTBUTYLPHENYL)4METHYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4bromo2methylphenyl)2((5(4tertbutylphenyl)4methyl4H124triazol3yl)sulfanyl)acetamide
ZINC000002453060
ZINC02453060
ZINC2453060
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