Vitas-M small molecule compound

3-hexyl-4,8-dimethyl-7-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one

Catalog ID
STK717582
SMILES CCCCCCc1c(=O)oc2c(c1C)ccc(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 C19H24N4O3 MW 356.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H24N4O3/c1-4-5-6-7-8-15-12(2)14-9-10-16(13(3)18(14)26-19(15)24)25-11-17-20-22-23-21-17/h9-10H,4-8,11H2,1-3H3,(H,20,21,22,23)
InChIKey
OWQAQSZEBWWIOR-UHFFFAOYSA-N
Synonyms
862128-87-8
3hexyl48dimethyl7(1Htetrazol5ylmethoxy)2Hchromen2one
3HEXYL48DIMETHYL7(2HTETRAZOL5YLMETHOXY)CHROMEN2ONE
7((2Htetrazol5yl)methoxy)3hexyl48dimethyl2Hchromen2one
862128878
CCCCCCC1=C(C2=C(C(=C(C=C2)OCC3=NNN=N3)C)OC1=O)C
CCCCCCc1c(=O)oc2c(c1C)ccc(c2C)OCc1n(nH)nn1
CCCCCCc1c(=O)oc2c(c1C)ccc(c2C)OCc1nnn(nH)1
InChI=1SC19H24N4O3c1456781512(2)1491016(13(3)18(14)2619(15)24)2511172022232117h910H4811H213H3(H20212223)
MFCD10041094
ZINC000002449384
ZINC2449384

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Available files

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