Vitas-M small molecule compound
ethyl 5-[(benzylsulfonyl)methyl]-1-[4-(1H-pyrrol-1-yl)-1,2,5-oxadiazol-3-yl]-1H-1,2,3-triazole-4-carboxylate
Catalog ID
STK783334
SMILES CCOC(=O)c1nnn(c1CS(=O)(=O)Cc1ccccc1)c1nonc1n1cccc1
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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 C19H18N6O5S MW 442.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N6O5S/c1-2-29-19(26)16-15(13-31(27,28)12-14-8-4-3-5-9-14)25(23-20-16)18-17(21-30-22-18)24-10-6-7-11-24/h3-11H,2,12-13H2,1H3InChIKey
PJDCRDNYDKGVKB-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N(N=N1)C2=NON=C2N3C=CC=C3)CS(=O)(=O)CC4=CC=CC=C4
ethyl5((benzylsulfonyl)methyl)1(4(1Hpyrrol1yl)125oxadiazol3yl)1H123triazole4carboxylate
ETHYL5((BENZYLSULFONYL)METHYL)1(4PYRROLYL(125OXADIAZOL3YL))123TRIAZOLE4CARBOXYLATE
ETHYL5(BENZYLSULFONYLMETHYL)1(4PYRROL1YL125OXADIAZOL3YL)TRIAZOLE4CARBOXYLATE
InChI=1SC19H18N6O5Sc122919(26)1615(1331(2728)12148435914)25(232016)1817(21302218)2410671124h311H21213H21H3
MFCD06618069
ZINC000012413752
ZINC12413752
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