Vitas-M small molecule compound
3,4-dimethyl-7-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one
Catalog ID
STK717572
SMILES O=c1oc2cc(OCc3nnn[nH]3)ccc2c(c1C)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 C13H12N4O3 MW 272.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12N4O3/c1-7-8(2)13(18)20-11-5-9(3-4-10(7)11)19-6-12-14-16-17-15-12/h3-5H,6H2,1-2H3,(H,14,15,16,17)InChIKey
XWZJNKHNVJQGNM-UHFFFAOYSA-NSynonyms
849004-88-234dimethyl7(1Htetrazol5ylmethoxy)2Hchromen2one
34DIMETHYL7(2HTETRAZOL5YLMETHOXY)CHROMEN2ONE
7((2Htetrazol5yl)methoxy)34dimethyl2Hchromen2one
849004882
CC1=C(C(=O)OC2=C1C=CC(=C2)OCC3=NNN=N3)C
InChI=1SC13H12N4O3c178(2)13(18)201159(3410(7)11)196121416171512h35H6H212H3(H14151617)
MFCD10041084
O=c1oc2cc(OCc3n(nH)nn3)ccc2c(c1C)C
O=c1oc2cc(OCc3nnn(nH)3)ccc2c(c1C)C
ZINC000002450425
ZINC2450425
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