Vitas-M small molecule compound
N-(4-bromophenyl)-2-({5-[(2,4-dimethylphenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Catalog ID
STK245541
SMILES O=C(Nc1ccc(cc1)Br)CSc1nnc(n1C)COc1ccc(cc1C)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 C20H21BrN4O2S MW 461.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21BrN4O2S/c1-13-4-9-17(14(2)10-13)27-11-18-23-24-20(25(18)3)28-12-19(26)22-16-7-5-15(21)6-8-16/h4-10H,11-12H2,1-3H3,(H,22,26)InChIKey
WVQNSVXYWXLIGC-UHFFFAOYSA-NSynonyms
CC1=CC(=C(C=C1)OCC2=NN=C(N2C)SCC(=O)NC3=CC=C(C=C3)Br)C
InChI=1SC20H21BrN4O2Sc1134917(14(2)1013)271118232420(25(18)3)281219(26)22167515(21)6816h410H1112H213H3(H2226)
MFCD06139529
N(4BROMOPHENYL)2((5((24DIMETHYLPHENOXY)METHYL)4METHYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4BROMOPHENYL)2((5((24DIMETHYLPHENOXY)METHYL)4METHYL4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4BROMOPHENYL)2(5(24DIMETHYLPHENOXYMETHYL)4METHYL4H(124)TRIAZOL3YLSULFANYL)ACETAMIDE
ZINC000009306255
ZINC09306255
ZINC9306255
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