Vitas-M small molecule compound
3,5-dibromo-N-{[2-(4-chlorobenzyl)-1,3-benzoxazol-5-yl]carbamothioyl}-2-methoxybenzamide
Catalog ID
STK233922
SMILES COc1c(Br)cc(cc1C(=O)NC(=S)Nc1ccc2c(c1)nc(o2)Cc1ccc(cc1)Cl)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 C23H16Br2ClN3O3S MW 609.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16Br2ClN3O3S/c1-31-21-16(9-13(24)10-17(21)25)22(30)29-23(33)27-15-6-7-19-18(11-15)28-20(32-19)8-12-2-4-14(26)5-3-12/h2-7,9-11H,8H2,1H3,(H2,27,29,30,33)InChIKey
HQCMYWMKMOGYJM-UHFFFAOYSA-NSynonyms
35dibromoN((2((4chlorophenyl)methyl)13benzoxazol5yl)carbamothioyl)2methoxybenzamide
35dibromoN((2(4chlorobenzyl)13benzoxazol5yl)carbamothioyl)2methoxybenzamide
COC1=C(C=C(C=C1C(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)CC4=CC=C(C=C4)Cl)Br)Br
InChI=1SC23H16Br2ClN3O3Sc1312116(913(24)1017(21)25)22(30)2923(33)2715671918(1115)2820(3219)8122414(26)5312h27911H8H21H3(H227293033)
MFCD08098398
ZINC000097996946
ZINC97996946
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