Vitas-M small molecule compound
4-butyl-7-methyl-5-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one
Catalog ID
STK717591
SMILES CCCCc1cc(=O)oc2c1c(OCc1nnn[nH]1)cc(c2)C
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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)23-13-7-10(2)6-12(16(11)13)22-9-14-17-19-20-18-14/h6-8H,3-5,9H2,1-2H3,(H,17,18,19,20)InChIKey
ALTLOEBOPFEMNN-UHFFFAOYSA-NSynonyms
862184-67-64butyl7methyl5(1Htetrazol5ylmethoxy)2Hchromen2one
4BUTYL7METHYL5(2HTETRAZOL5YLMETHOXY)1BENZOPYRAN2ONE
4BUTYL7METHYL5(2HTETRAZOL5YLMETHOXY)CHROMEN2ONE
4BUTYL7METHYL5(2HTETRAZOL5YLMETHOXY)COUMARIN
5((2Htetrazol5yl)methoxy)4butyl7methyl2Hchromen2one
862184676
CCCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OCC3=NNN=N3
CCCCc1cc(=O)oc2c1c(OCc1n(nH)nn1)cc(c2)C
CCCCc1cc(=O)oc2c1c(OCc1nnn(nH)1)cc(c2)C
InChI=1SC16H18N4O3c134511815(21)2313710(2)612(16(11)13)229141719201814h68H359H212H3(H17181920)
MFCD10041104
ZINC000013115582
ZINC13115582
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