Vitas-M small molecule compound
N-(4-bromo-2-methylphenyl)-2-{[5-(4-methylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STL293750
SMILES C=CCn1c(SCC(=O)Nc2ccc(cc2C)Br)nnc1c1ccc(cc1)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 C21H21BrN4OS MW 457.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21BrN4OS/c1-4-11-26-20(16-7-5-14(2)6-8-16)24-25-21(26)28-13-19(27)23-18-10-9-17(22)12-15(18)3/h4-10,12H,1,11,13H2,2-3H3,(H,23,27)InChIKey
CXSHPFSKKBAHSH-UHFFFAOYSA-NSynonyms
849826-40-02((4allyl5(ptolyl)4H124triazol3yl)thio)N(4bromo2methylphenyl)acetamide
849826400
CC1=CC=C(C=C1)C2=NN=C(N2CC=C)SCC(=O)NC3=C(C=C(C=C3)Br)C
InChI=1SC21H21BrN4OSc14112620(167514(2)6816)242521(26)281319(27)231810917(22)1215(18)3h41012H11113H223H3(H2327)
MFCD04375739
N(4bromo2methylphenyl)2((5(4methylphenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetamide
N(4BROMO2METHYLPHENYL)2((5(4METHYLPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4BROMO2METHYLPHENYL)2(5(4METHYLPHENYL)4PROP2ENYL(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000009499895
ZINC09499895
ZINC9499895
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