Vitas-M small molecule compound
2-({2-[(5-benzyl-1,3-thiazol-2-yl)amino]-2-oxoethyl}sulfanyl)-3-(4-bromophenyl)propanoic acid
Catalog ID
STL017468
SMILES O=C(Nc1ncc(s1)Cc1ccccc1)CSC(C(=O)O)Cc1ccc(cc1)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 C21H19BrN2O3S2 MW 491.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19BrN2O3S2/c22-16-8-6-15(7-9-16)11-18(20(26)27)28-13-19(25)24-21-23-12-17(29-21)10-14-4-2-1-3-5-14/h1-9,12,18H,10-11,13H2,(H,26,27)(H,23,24,25)InChIKey
BUPQLCOJNKKCPT-UHFFFAOYSA-NSynonyms
868213-17-62((2((5benzyl13thiazol2yl)amino)2oxoethyl)sulfanyl)3(4bromophenyl)propanoicacid
2((2((5BENZYLTHIAZOL2YL)AMINO)2OXOETHYL)THIO)3(4BROMOPHENYL)PROPANOICACID
2(2((5benzyl13thiazol2yl)amino)2oxoethyl)sulfanyl3(4bromophenyl)propanoicacid
3(4BROMOPHENYL)2((N(5BENZYL(13THIAZOL2YL))CARBAMOYL)METHYLTHIO)PROPANOICACID
868213176
C1=CC=C(C=C1)CC2=CN=C(S2)NC(=O)CSC(CC3=CC=C(C=C3)Br)C(=O)O
InChI=1SC21H19BrN2O3S2c22168615(7916)1118(20(26)27)281319(25)2421231217(2921)10144213514h191218H101113H2(H2627)(H232425)
MFCD05847608
ZINC000002709924
ZINC000002709927
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