Vitas-M small molecule compound
5-methyl-2-(propan-2-yl)cyclohexyl [(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetate
Catalog ID
STK279539
SMILES COc1ccc2c(c1)nc([nH]2)SCC(=O)OC1CC(C)CCC1C(C)C
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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 C20H28N2O3S MW 376.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28N2O3S/c1-12(2)15-7-5-13(3)9-18(15)25-19(23)11-26-20-21-16-8-6-14(24-4)10-17(16)22-20/h6,8,10,12-13,15,18H,5,7,9,11H2,1-4H3,(H,21,22)InChIKey
YXTOEUHUDZHTOH-UHFFFAOYSA-NSynonyms
1005040-25-4(5METHYL2PROPAN2YLCYCLOHEXYL)2((6METHOXY1HBENZIMIDAZOL2YL)SULFANYL)ACETATE
1005040254
5METHYL2(PROPAN2YL)CYCLOHEXYL((5METHOXY1HBENZIMIDAZOL2YL)SULFANYL)ACETATE
CC1CCC(C(C1)OC(=O)CSC2=NC3=C(N2)C=C(C=C3)OC)C(C)C
COc1ccc2c(c1)nc((nH)2)SCC(=O)OC1CC(C)CCC1C(C)C
InChI=1SC20H28N2O3Sc112(2)157513(3)918(15)2519(23)11262021168614(244)1017(16)2220h681012131518H57911H214H3(H2122)
MFCD09269905
ZINC000009096222
ZINC000009096225
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