Vitas-M small molecule compound
1-(4-chlorobenzyl)-5-(3,4-dimethoxyphenyl)-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione
Catalog ID
STL081483
SMILES COc1cc(ccc1OC)N1C(=O)C2C(C1=O)N=NN2Cc1ccc(cc1)Cl
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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 C19H17ClN4O4 MW 400.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17ClN4O4/c1-27-14-8-7-13(9-15(14)28-2)24-18(25)16-17(19(24)26)23(22-21-16)10-11-3-5-12(20)6-4-11/h3-9,16-17H,10H2,1-2H3InChIKey
CUPVQXOFHJWYMY-UHFFFAOYSA-NSynonyms
1009579-43-41(4CHLOROBENZYL)5(34DIMETHOXYPHENYL)16ADIHYDROPYRROLO(34D)(123)TRIAZOLE46(3AH5H)DIONE
1(4chlorobenzyl)5(34dimethoxyphenyl)3a6adihydropyrrolo(34d)(123)triazole46(1H5H)dione
1009579434
3((4chlorophenyl)methyl)5(34dimethoxyphenyl)3a6adihydropyrrolo(34d)triazole46dione
COC1=C(C=C(C=C1)N2C(=O)C3C(C2=O)N(N=N3)CC4=CC=C(C=C4)Cl)OC
InChI=1SC19H17ClN4O4c127148713(915(14)282)2418(25)1617(19(24)26)23(222116)10113512(20)6411h391617H10H212H3
MFCD07655741
ZINC000004483765
ZINC000101168190
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