Vitas-M small molecule compound
2-(2-oxo-2-{[4-(1H-1,2,4-triazol-1-ylmethyl)phenyl]amino}ethyl)benzoic acid
Catalog ID
STL155508
SMILES O=C(Cc1ccccc1C(=O)O)Nc1ccc(cc1)Cn1cncn1
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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 C18H16N4O3 MW 336.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N4O3/c23-17(9-14-3-1-2-4-16(14)18(24)25)21-15-7-5-13(6-8-15)10-22-12-19-11-20-22/h1-8,11-12H,9-10H2,(H,21,23)(H,24,25)InChIKey
GQRLSFCPHCAKPC-UHFFFAOYSA-NSynonyms
1211700-72-91211700729
2(2((4((1H124triazol1yl)methyl)phenyl)amino)2oxoethyl)benzoicacid
2(2oxo2((4(1H124triazol1ylmethyl)phenyl)amino)ethyl)benzoicacid
2(2oxo2(4(124triazol1ylmethyl)anilino)ethyl)benzoicacid
C1=CC=C(C(=C1)CC(=O)NC2=CC=C(C=C2)CN3C=NC=N3)C(=O)O
InChI=1SC18H16N4O3c2317(914312416(14)18(24)25)21157513(6815)10221219112022h181112H910H2(H2123)(H2425)
MFCD13583726
ZINC000044980313
ZINC44980313
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