Vitas-M small molecule compound
N-{[4-(1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-3-bromo-4-ethoxybenzamide
Catalog ID
STK081741
SMILES CCOc1ccc(cc1Br)C(=O)NC(=S)Nc1ccc(cc1)c1nc2c(o1)cccc2
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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 C23H18BrN3O3S MW 496.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18BrN3O3S/c1-2-29-19-12-9-15(13-17(19)24)21(28)27-23(31)25-16-10-7-14(8-11-16)22-26-18-5-3-4-6-20(18)30-22/h3-13H,2H2,1H3,(H2,25,27,28,31)InChIKey
JLMQNHHLHFKTGH-UHFFFAOYSA-NSynonyms
CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4O3)Br
CCOc1ccc(cc1Br)C(=O)NC(=S)Nc1ccc(cc1)c1nc2c(o1)cccc2
InChI=1SC23H18BrN3O3Sc12291912915(1317(19)24)21(28)2723(31)251610714(81116)222618534620(18)3022h313H2H21H3(H225272831)
MFCD02821158
N((4(13BENZOXAZOL2YL)PHENYL)CARBAMOTHIOYL)3BROMO4ETHOXYBENZAMIDE
STK081741
ZINC000002991087
ZINC02991087
ZINC2991087
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