Vitas-M small molecule compound
2-chloro-4-{5-[(E)-(4H-1,2,4-triazol-4-ylimino)methyl]furan-2-yl}benzoic acid
Catalog ID
STL384046
SMILES OC(=O)c1ccc(cc1Cl)c1ccc(o1)/C=N/n1cnnc1
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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 C14H9ClN4O3 MW 316.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H9ClN4O3/c15-12-5-9(1-3-11(12)14(20)21)13-4-2-10(22-13)6-18-19-7-16-17-8-19/h1-8H,(H,20,21)/b18-6+InChIKey
SHLMHTDBSPTFHH-NGYBGAFCSA-NSynonyms
2chloro4(5((E)(4H124triazol4ylimino)methyl)furan2yl)benzoicacid
2CHLORO4(5((E)124TRIAZOL4YLIMINOMETHYL)FURAN2YL)BENZOICACID
C1=CC(=C(C=C1C2=CC=C(O2)C=NN3C=NN=C3)Cl)C(=O)O
InChI=1SC14H9ClN4O3c151259(1311(12)14(20)21)134210(2213)6181971617819h18H(H2021)b186+
MFCD05040413
OC(=O)c1ccc(cc1Cl)c1ccc(o1)C=Nn1cnnc1
ZINC000000565896
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