Vitas-M small molecule compound
4-butyl-8-methyl-7-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one
Catalog ID
STK717586
SMILES CCCCc1cc(=O)oc2c1ccc(c2C)OCc1nnn[nH]1
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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 C16H18N4O3 MW 314.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4O3/c1-3-4-5-11-8-15(21)23-16-10(2)13(7-6-12(11)16)22-9-14-17-19-20-18-14/h6-8H,3-5,9H2,1-2H3,(H,17,18,19,20)InChIKey
JPJYTOVGEDKBDG-UHFFFAOYSA-NSynonyms
848995-81-34butyl8methyl7(1Htetrazol5ylmethoxy)2Hchromen2one
4BUTYL8METHYL7(2HTETRAZOL5YLMETHOXY)CHROMEN2ONE
7((2Htetrazol5yl)methoxy)4butyl8methyl2Hchromen2one
848995813
CCCCC1=CC(=O)OC2=C1C=CC(=C2C)OCC3=NNN=N3
CCCCc1cc(=O)oc2c1ccc(c2C)OCc1n(nH)nn1
CCCCc1cc(=O)oc2c1ccc(c2C)OCc1nnn(nH)1
InChI=1SC16H18N4O3c134511815(21)231610(2)13(7612(11)16)229141719201814h68H359H212H3(H17181920)
MFCD10041099
ZINC000012733627
ZINC12733627
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