Vitas-M small molecule compound
phenyl {[1-(4-bromophenyl)-1H-tetrazol-5-yl](3-nitrophenyl)methyl}methylcarbamate
Catalog ID
STK048639
SMILES Brc1ccc(cc1)n1nnnc1C(N(C(=O)Oc1ccccc1)C)c1cccc(c1)[N+](=O)[O-]
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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 C22H17BrN6O4 MW 509.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17BrN6O4/c1-27(22(30)33-19-8-3-2-4-9-19)20(15-6-5-7-18(14-15)29(31)32)21-24-25-26-28(21)17-12-10-16(23)11-13-17/h2-14,20H,1H3InChIKey
LUNJZXAETWWXDR-UHFFFAOYSA-NSynonyms
Brc1ccc(cc1)n1nnnc1C(N(C(=O)Oc1ccccc1)C)c1cccc(c1)(N+)(=O)(O)
CN(C(C1=CC(=CC=C1)(N+)(=O)(O))C2=NN=NN2C3=CC=C(C=C3)Br)C(=O)OC4=CC=CC=C4
InChI=1SC22H17BrN6O4c127(22(30)33198324919)20(1565718(1415)29(31)32)2124252628(21)17121016(23)111317h21420H1H3
MFCD08050993
PHENYL((1(4BROMOPHENYL)1HTETRAZOL5YL)(3NITROPHENYL)METHYL)METHYLCARBAMATE
PHENYLN((1(4BROMOPHENYL)TETRAZOL5YL)(3NITROPHENYL)METHYL)NMETHYLCARBAMATE
STK048639
ZINC000009434514
ZINC000013943385
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