Vitas-M small molecule compound

3-(1H-tetrazol-1-yl)phenyl 4-tert-butylbenzoate

Catalog ID
STK519089
SMILES O=C(c1ccc(cc1)C(C)(C)C)Oc1cccc(c1)n1cnnn1

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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 C18H18N4O2 MW 322.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N4O2/c1-18(2,3)14-9-7-13(8-10-14)17(23)24-16-6-4-5-15(11-16)22-12-19-20-21-22/h4-12H,1-3H3
InChIKey
FRVQNFJFVTXKIF-UHFFFAOYSA-N
Synonyms
912894-85-0
(3(tetrazol1yl)phenyl)4tertbutylbenzoate
3(1Htetrazol1yl)phenyl4tertbutylbenzoate
912894850
CC(C)(C)C1=CC=C(C=C1)C(=O)OC2=CC=CC(=C2)N3C=NN=N3
InChI=1SC18H18N4O2c118(23)149713(81014)17(23)241664515(1116)221219202122h412H13H3
MFCD12918693
ZINC000021798365
ZINC21798365

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Available files

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