Vitas-M small molecule compound
6-chloro-3-hexyl-4-methyl-7-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one
Catalog ID
STK717585
SMILES CCCCCCc1c(=O)oc2c(c1C)cc(c(c2)OCc1nnn[nH]1)Cl
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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 C18H21ClN4O3 MW 376.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21ClN4O3/c1-3-4-5-6-7-12-11(2)13-8-14(19)16(9-15(13)26-18(12)24)25-10-17-20-22-23-21-17/h8-9H,3-7,10H2,1-2H3,(H,20,21,22,23)InChIKey
JSMUDRHEPVSLLT-UHFFFAOYSA-NSynonyms
861147-34-46chloro3hexyl4methyl7(1Htetrazol5ylmethoxy)2Hchromen2one
6CHLORO3HEXYL4METHYL7(2HTETRAZOL5YLMETHOXY)CHROMEN2ONE
7((2Htetrazol5yl)methoxy)6chloro3hexyl4methyl2Hchromen2one
861147344
CCCCCCC1=C(C2=CC(=C(C=C2OC1=O)OCC3=NNN=N3)Cl)C
CCCCCCc1c(=O)oc2c(c1C)cc(c(c2)OCc1n(nH)nn1)Cl
CCCCCCc1c(=O)oc2c(c1C)cc(c(c2)OCc1nnn(nH)1)Cl
InChI=1SC18H21ClN4O3c1345671211(2)13814(19)16(915(13)2618(12)24)2510172022232117h89H3710H212H3(H20212223)
MFCD10041098
ZINC000013804354
ZINC13804354
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