Vitas-M small molecule compound
3-bromobenzyl 4-{5-[(2-ethoxy-2-oxoethyl)sulfanyl]-1H-tetrazol-1-yl}benzoate
Catalog ID
STK765906
SMILES CCOC(=O)CSc1nnnn1c1ccc(cc1)C(=O)OCc1cccc(c1)Br
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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 C19H17BrN4O4S MW 477.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17BrN4O4S/c1-2-27-17(25)12-29-19-21-22-23-24(19)16-8-6-14(7-9-16)18(26)28-11-13-4-3-5-15(20)10-13/h3-10H,2,11-12H2,1H3InChIKey
IKWOPGQLOJKUET-UHFFFAOYSA-NSynonyms
431073-92-6(3BROMOPHENYL)METHYL4(5(2ETHOXY2OXOETHYL)SULFANYLTETRAZOL1YL)BENZOATE
3bromobenzyl4(5((2ethoxy2oxoethyl)sulfanyl)1Htetrazol1yl)benzoate
3bromobenzyl4(5((2ethoxy2oxoethyl)thio)1Htetrazol1yl)benzoate
431073926
CCOC(=O)CSC1=NN=NN1C2=CC=C(C=C2)C(=O)OCC3=CC(=CC=C3)Br
InChI=1SC19H17BrN4O4Sc122717(25)12291921222324(19)168614(7916)18(26)28111343515(20)1013h310H21112H21H3
ZINC000001151900
ZINC01151900
ZINC1151900
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