Vitas-M small molecule compound
2-(3-cyclopropyl-5-methyl-4H-1,2,4-triazol-4-yl)benzoic acid
Catalog ID
STK664176
SMILES OC(=O)c1ccccc1n1c(C)nnc1C1CC1
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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 C13H13N3O2 MW 243.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13N3O2/c1-8-14-15-12(9-6-7-9)16(8)11-5-3-2-4-10(11)13(17)18/h2-5,9H,6-7H2,1H3,(H,17,18)InChIKey
ZZYSWMZPDNLUKF-UHFFFAOYSA-NSynonyms
890093-19-32(3CYCLOPROPYL5METHYL124TRIAZOL4YL)BENZOICACID
2(3cyclopropyl5methyl4H124triazol4yl)benzoicacid
2(5CYCLOPROPYL3METHYL124TRIAZOL4YL)BENZOICACID
890093193
BENZOICACID2(3CYCLOPROPYL5METHYL4H124TRIAZOL4YL)
CC1=NN=C(N1C2=CC=CC=C2C(=O)O)C3CC3
InChI=1SC13H13N3O2c18141512(9679)16(8)11532410(11)13(17)18h259H67H21H3(H1718)
MFCD07801051
ZINC000004344275
ZINC4344275
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