Vitas-M small molecule compound
ethyl 2-[(2Z)-1,3-benzoxazol-2(3H)-ylideneamino]-4-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}pyrimidine-5-carboxylate
Catalog ID
STK578286
SMILES CCOC(=O)c1cnc(nc1CSc1nnnn1c1ccccc1)/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 C22H18N8O3S MW 474.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N8O3S/c1-2-32-19(31)15-12-23-20(26-21-25-16-10-6-7-11-18(16)33-21)24-17(15)13-34-22-27-28-29-30(22)14-8-4-3-5-9-14/h3-12H,2,13H2,1H3,(H,23,24,25,26)InChIKey
NXECCEKYVZLFBT-UHFFFAOYSA-NSynonyms
726199-56-0CCOC(=O)c1cnc(nc1CSc1nnnn1c1ccccc1)N=c1oc2c((nH)1)cccc2
ethyl2((2Z)13benzoxazol2(3H)ylideneamino)4(((1phenyl1Htetrazol5yl)sulfanyl)methyl)pyrimidine5carboxylate
MFCD07199676
ZINC000009109025
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