Vitas-M small molecule compound
ethyl 4-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-2-[(2E)-1,3-benzoxazol-2(3H)-ylideneamino]pyrimidine-5-carboxylate
Catalog ID
STK848479
SMILES CCOC(=O)c1cnc(nc1CSc1nc2c(s1)cccc2)/N=c\1/oc2c([nH]1)cccc2
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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 C22H17N5O3S2 MW 463.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N5O3S2/c1-2-29-19(28)13-11-23-20(27-21-25-14-7-3-5-9-17(14)30-21)24-16(13)12-31-22-26-15-8-4-6-10-18(15)32-22/h3-11H,2,12H2,1H3,(H,23,24,25,27)InChIKey
YNHYCOHULKCFEE-UHFFFAOYSA-NSynonyms
669746-27-4669746274
CCOC(=O)c1cnc(nc1CSc1nc2c(s1)cccc2)N=c1oc2c((nH)1)cccc2
ethyl4((13benzothiazol2ylsulfanyl)methyl)2((2E)13benzoxazol2(3H)ylideneamino)pyrimidine5carboxylate
MFCD07212159
ZINC000008969216
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