Vitas-M small molecule compound
3-(2,5-dichlorophenyl)-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]propanoic acid
Catalog ID
STK731816
SMILES OC(=O)C(Sc1nc2c([nH]1)cc(cc2)C)Cc1cc(Cl)ccc1Cl
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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 C17H14Cl2N2O2S MW 381.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14Cl2N2O2S/c1-9-2-5-13-14(6-9)21-17(20-13)24-15(16(22)23)8-10-7-11(18)3-4-12(10)19/h2-7,15H,8H2,1H3,(H,20,21)(H,22,23)InChIKey
GPIXLZMBKNGRSR-UHFFFAOYSA-NSynonyms
627889-79-6(2R)3(25DICHLOROPHENYL)2((6METHYL1HBENZIMIDAZOL2YL)SULFANYL)PROPANOICACID
3(25dichlorophenyl)2((6methyl1Hbenzimidazol2yl)sulfanyl)propanoicacid
3(25dichlorophenyl)2((6methyl1Hbenzo(d)imidazol2yl)thio)propanoicacid
3(25DICHLOROPHENYL)2(5METHYLBENZIMIDAZOL2YLTHIO)PROPANOICACID
627889796
CC1=CC2=C(C=C1)N=C(N2)SC(CC3=C(C=CC(=C3)Cl)Cl)C(=O)O
InChI=1SC17H14Cl2N2O2Sc19251314(69)2117(2013)2415(16(22)23)810711(18)3412(10)19h2715H8H21H3(H2021)(H2223)
MFCD04169127
OC(=O)C(Sc1nc2c((nH)1)cc(cc2)C)Cc1cc(Cl)ccc1Cl
ZINC000001453213
ZINC000001453214
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