Vitas-M small molecule compound
2-bromo-N-[(4-methyl-5-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]benzamide
Catalog ID
STK497533
SMILES O=C(N1CCOCC1)CSc1nnc(n1C)CNC(=O)c1ccccc1Br
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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 C17H20BrN5O3S MW 454.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20BrN5O3S/c1-22-14(10-19-16(25)12-4-2-3-5-13(12)18)20-21-17(22)27-11-15(24)23-6-8-26-9-7-23/h2-5H,6-11H2,1H3,(H,19,25)InChIKey
WNTYYMXSBFOOHR-UHFFFAOYSA-NSynonyms
2bromoN((4methyl5((2(morpholin4yl)2oxoethyl)sulfanyl)4H124triazol3yl)methyl)benzamide
2bromoN((4methyl5(2morpholin4yl2oxoethyl)sulfanyl124triazol3yl)methyl)benzamide
CN1C(=NN=C1SCC(=O)N2CCOCC2)CNC(=O)C3=CC=CC=C3Br
InChI=1SC17H20BrN5O3Sc12214(101916(25)12423513(12)18)202117(22)271115(24)2368269723h25H611H21H3(H1925)
MFCD11854921
ZINC000032579264
ZINC32579264
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