Vitas-M small molecule compound
methyl 3-{[(5,6-dimethyl-1H-benzimidazol-2-yl)sulfanyl]methyl}benzoate
Catalog ID
STK113384
SMILES COC(=O)c1cccc(c1)CSc1[nH]c2c(n1)cc(c(c2)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 C18H18N2O2S MW 326.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O2S/c1-11-7-15-16(8-12(11)2)20-18(19-15)23-10-13-5-4-6-14(9-13)17(21)22-3/h4-9H,10H2,1-3H3,(H,19,20)InChIKey
YVDAWJBTKCOAAX-UHFFFAOYSA-NSynonyms
CC1=CC2=C(C=C1C)N=C(N2)SCC3=CC=CC(=C3)C(=O)OC
COC(=O)c1cccc(c1)CSc1(nH)c2c(n1)cc(c(c2)C)C
InChI=1SC18H18N2O2Sc11171516(812(11)2)2018(1915)23101354614(913)17(21)223h49H10H213H3(H1920)
METHYL3(((56DIMETHYL1HBENZIMIDAZOL2YL)SULFANYL)METHYL)BENZOATE
METHYL3((56DIMETHYL1HBENZIMIDAZOL2YL)SULFANYLMETHYL)BENZOATE
MFCD03368370
ZINC000001439788
ZINC01439788
ZINC1439788
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