Vitas-M small molecule compound
3-phenyl-4-[3-(pyrazin-2-yl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]butanoic acid
Catalog ID
STK683331
SMILES OC(=O)CC(c1ccccc1)Cn1c(S)nnc1c1nccnc1
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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 C16H15N5O2S MW 341.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N5O2S/c22-14(23)8-12(11-4-2-1-3-5-11)10-21-15(19-20-16(21)24)13-9-17-6-7-18-13/h1-7,9,12H,8,10H2,(H,20,24)(H,22,23)InChIKey
VTKFMHPLAGRKGW-UHFFFAOYSA-NSynonyms
3phenyl4(3(pyrazin2yl)5sulfanyl4H124triazol4yl)butanoicacid
3PHENYL4(3PYRAZIN2YL5SULFANYLIDENE1H124TRIAZOL4YL)BUTANOICACID
4H124TRIAZOLE4BUTANOICACID3MERCAPTOBETAPHENYL5(2PYRAZINYL)
C1=CC=C(C=C1)C(CC(=O)O)CN2C(=NNC2=S)C3=NC=CN=C3
InChI=1SC16H15N5O2Sc2214(23)812(114213511)102115(192016(21)24)13917671813h17912H810H2(H2024)(H2223)
MFCD05257445
ZINC000004623181
ZINC000004686604
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