Vitas-M small molecule compound
(2E)-3-(3-{5-[(2-fluorobenzyl)sulfanyl]-1H-tetrazol-1-yl}phenyl)prop-2-enoic acid
Catalog ID
STL050850
SMILES OC(=O)/C=C/c1cccc(c1)n1nnnc1SCc1ccccc1F
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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 C17H13FN4O2S MW 356.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13FN4O2S/c18-15-7-2-1-5-13(15)11-25-17-19-20-21-22(17)14-6-3-4-12(10-14)8-9-16(23)24/h1-10H,11H2,(H,23,24)/b9-8+InChIKey
MPKUAGVSRWIZKD-CMDGGOBGSA-NSynonyms
(2E)3(3(5((2fluorobenzyl)sulfanyl)1Htetrazol1yl)phenyl)prop2enoicacid
(E)3(3(5((2FLUOROPHENYL)METHYLSULFANYL)TETRAZOL1YL)PHENYL)PROP2ENOICACID
(Z)3(3(5((2fluorobenzyl)thio)1Htetrazol1yl)phenyl)acrylicacid
C1=CC=C(C(=C1)CSC2=NN=NN2C3=CC=CC(=C3)C=CC(=O)O)F
InChI=1SC17H13FN4O2Sc1815721513(15)11251719202122(17)1463412(1014)8916(23)24h110H11H2(H2324)b98+
MFCD03942467
OC(=O)C=Cc1cccc(c1)n1nnnc1SCc1ccccc1F
ZINC000017207668
ZINC17207668
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