Vitas-M small molecule compound
ethyl 4-{5-[morpholin-4-yl(3-nitrophenyl)methyl]-1H-tetrazol-1-yl}benzoate
Catalog ID
STK089741
SMILES CCOC(=O)c1ccc(cc1)n1nnnc1C(c1cccc(c1)[N+](=O)[O-])N1CCOCC1
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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 C21H22N6O5 MW 438.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N6O5/c1-2-32-21(28)15-6-8-17(9-7-15)26-20(22-23-24-26)19(25-10-12-31-13-11-25)16-4-3-5-18(14-16)27(29)30/h3-9,14,19H,2,10-13H2,1H3InChIKey
UKSLTJRBOWWSJF-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)N2C(=NN=N2)C(C3=CC(=CC=C3)(N+)(=O)(O))N4CCOCC4
CCOC(=O)c1ccc(cc1)n1nnnc1C(c1cccc(c1)(N+)(=O)(O))N1CCOCC1
ETHYL4(5(MORPHOLIN4YL(3NITROPHENYL)METHYL)1HTETRAZOL1YL)BENZOATE
ETHYL4(5(MORPHOLIN4YL(3NITROPHENYL)METHYL)TETRAZOL1YL)BENZOATE
ETHYL4(5(MORPHOLINO(3NITROPHENYL)METHYL)1HTETRAZOL1YL)BENZOATE
InChI=1SC21H22N6O5c123221(28)156817(9715)2620(22232426)19(25101231131125)1643518(1416)27(29)30h391419H21013H21H3
MFCD03764778
STK089741
ZINC000022078831
ZINC000022078833
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