Vitas-M small molecule compound
2-bromo-N-[(2E)-5-(1-phenylpropyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Catalog ID
STL039595
SMILES CCC(c1n[nH]/c(=N\C(=O)c2ccccc2Br)/s1)c1ccccc1
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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 C18H16BrN3OS MW 402.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16BrN3OS/c1-2-13(12-8-4-3-5-9-12)17-21-22-18(24-17)20-16(23)14-10-6-7-11-15(14)19/h3-11,13H,2H2,1H3,(H,20,22,23)InChIKey
VILQTFGVNDIMDU-UHFFFAOYSA-NSynonyms
346645-14-52bromoN((2E)5(1phenylpropyl)134thiadiazol2(3H)ylidene)benzamide
2BROMON(5(1PHENYLPROPYL)134THIADIAZOL2YL)BENZAMIDE
346645145
CCC(C1=CC=CC=C1)C2=NN=C(S2)NC(=O)C3=CC=CC=C3Br
CCC(c1n(nH)c(=NC(=O)c2ccccc2Br)s1)c1ccccc1
InChI=1SC18H16BrN3OSc1213(128435912)17212218(2417)2016(23)1410671115(14)19h31113H2H21H3(H202223)
MFCD04074367
ZINC000006554973
ZINC000006555383
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