Vitas-M small molecule compound
2-{[4-(4-bromophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methylphenyl)acetamide
Catalog ID
STK554453
SMILES O=C(Nc1ccc(cc1)C)CSc1nnc(n1c1ccc(cc1)Br)c1ccncc1
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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 C22H18BrN5OS MW 480.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18BrN5OS/c1-15-2-6-18(7-3-15)25-20(29)14-30-22-27-26-21(16-10-12-24-13-11-16)28(22)19-8-4-17(23)5-9-19/h2-13H,14H2,1H3,(H,25,29)InChIKey
JTCXWZKUAGETPW-UHFFFAOYSA-NSynonyms
769165-64-22((4(4bromophenyl)5(pyridin4yl)4H124triazol3yl)sulfanyl)N(4methylphenyl)acetamide
2((4(4bromophenyl)5(pyridin4yl)4H124triazol3yl)thio)N(ptolyl)acetamide
2((4(4BROMOPHENYL)5PYRIDIN4YL124TRIAZOL3YL)SULFANYL)N(4METHYLPHENYL)ACETAMIDE
2(4(4BROMOPHENYL)5(4PYRIDYL)(124TRIAZOL3YLTHIO))N(4METHYLPHENYL)ACETAMIDE
769165642
CC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)Br)C4=CC=NC=C4
InChI=1SC22H18BrN5OSc1152618(7315)2520(29)143022272621(16101224131116)28(22)198417(23)5919h213H14H21H3(H2529)
MFCD03224651
ZINC000002506997
ZINC02506997
ZINC2506997
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