Vitas-M small molecule compound
N-[1-(5-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)-2-methylpropyl]-3-methylbenzamide
Catalog ID
STK139970
SMILES CC(C(c1nnc(n1C)SCC(=O)c1ccc(cc1)Br)NC(=O)c1cccc(c1)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 C23H25BrN4O2S MW 501.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25BrN4O2S/c1-14(2)20(25-22(30)17-7-5-6-15(3)12-17)21-26-27-23(28(21)4)31-13-19(29)16-8-10-18(24)11-9-16/h5-12,14,20H,13H2,1-4H3,(H,25,30)InChIKey
KAQKFPYVCCWQRX-UHFFFAOYSA-NSynonyms
CC1=CC=CC(=C1)C(=O)NC(C2=NN=C(N2C)SCC(=O)C3=CC=C(C=C3)Br)C(C)C
InChI=1SC23H25BrN4O2Sc114(2)20(2522(30)1775615(3)1217)21262723(28(21)4)311319(29)1681018(24)11916h5121420H13H214H3(H2530)
MFCD04212109
N(1(5((2(4BROMOPHENYL)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)2METHYLPROPYL)3METHYLBENZAMIDE
N(1(5(2(4BROMOPHENYL)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)2METHYLPROPYL)3METHYLBENZAMIDE
ZINC000001132450
ZINC000001132453
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