Vitas-M small molecule compound
3-bromo-N-[2-(5-{[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetyl]amino}-1,3,4-thiadiazol-2-yl)ethyl]benzamide
Catalog ID
STL261664
SMILES O=C(CN1C(=O)c2c(C1=O)cccc2)Nc1nnc(s1)CCNC(=O)c1cccc(c1)Br
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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 C21H16BrN5O4S MW 514.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16BrN5O4S/c22-13-5-3-4-12(10-13)18(29)23-9-8-17-25-26-21(32-17)24-16(28)11-27-19(30)14-6-1-2-7-15(14)20(27)31/h1-7,10H,8-9,11H2,(H,23,29)(H,24,26,28)InChIKey
LBCISYXXISLNJS-UHFFFAOYSA-NSynonyms
3bromoN(2(5(((13dioxo13dihydro2Hisoindol2yl)acetyl)amino)134thiadiazol2yl)ethyl)benzamide
3bromoN(2(5((2(13dioxoisoindol2yl)acetyl)amino)134thiadiazol2yl)ethyl)benzamide
C1=CC=C2C(=C1)C(=O)N(C2=O)CC(=O)NC3=NN=C(S3)CCNC(=O)C4=CC(=CC=C4)Br
InChI=1SC21H16BrN5O4Sc221353412(1013)18(29)239817252621(3217)2416(28)112719(30)14612715(14)20(27)31h1710H8911H2(H2329)(H242628)
MFCD09433558
ZINC000017971134
ZINC17971134
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