Vitas-M small molecule compound
benzyl 7-(2,5-dimethoxyphenyl)-5-methyl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate
Catalog ID
STL199149
SMILES COc1ccc(c(c1)C1C(=C(C)Nc2n1nnn2)C(=O)OCc1ccccc1)OC
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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 C21H21N5O4 MW 407.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O4/c1-13-18(20(27)30-12-14-7-5-4-6-8-14)19(26-21(22-13)23-24-25-26)16-11-15(28-2)9-10-17(16)29-3/h4-11,19H,12H2,1-3H3,(H,22,23,25)InChIKey
QWARCOGAPHHYPP-UHFFFAOYSA-NSynonyms
BENZYL7(25DIMETHOXYPHENYL)5METHYL17DIHYDROTETRAZOLO(15A)PYRIMIDINE6CARBOXYLATE
benzyl7(25dimethoxyphenyl)5methyl47dihydrotetrazolo(15a)pyrimidine6carboxylate
CC1=C(C(N2C(=N1)N=NN2)C3=C(C=CC(=C3)OC)OC)C(=O)OCC4=CC=CC=C4
InChI=1SC21H21N5O4c11318(20(27)3012147546814)19(2621(2213)23242526)161115(282)91017(16)293h41119H12H213H3(H222325)
MFCD02971594
ZINC000000950936
ZINC000000950937
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