Vitas-M small molecule compound
2,2-dimethyl-3-({4-[5-(propan-2-yl)-1H-1,2,4-triazol-3-yl]phenyl}carbamoyl)cyclopropanecarboxylic acid
Catalog ID
STL244711
SMILES O=C(C1C(C1(C)C)C(=O)O)Nc1ccc(cc1)c1n[nH]c(n1)C(C)C
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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 C18H22N4O3 MW 342.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N4O3/c1-9(2)14-20-15(22-21-14)10-5-7-11(8-6-10)19-16(23)12-13(17(24)25)18(12,3)4/h5-9,12-13H,1-4H3,(H,19,23)(H,24,25)(H,20,21,22)InChIKey
GEKXMZNQRGKABI-UHFFFAOYSA-NSynonyms
1324073-27-91324073279
22dimethyl3((4(5(propan2yl)1H124triazol3yl)phenyl)carbamoyl)cyclopropanecarboxylicacid
22dimethyl3((4(5propan2yl1H124triazol3yl)phenyl)carbamoyl)cyclopropane1carboxylicacid
3((4(3isopropyl1H124triazol5yl)phenyl)carbamoyl)22dimethylcyclopropanecarboxylicacid
CC(C)C1=NC(=NN1)C2=CC=C(C=C2)NC(=O)C3C(C3(C)C)C(=O)O
CC(c1nc((nH)n1)c1ccc(cc1)NC(=O)C1C(C1(C)C)C(=O)O)C
InChI=1SC18H22N4O3c19(2)142015(222114)105711(8610)1916(23)1213(17(24)25)18(123)4h591213H14H3(H1923)(H2425)(H202122)
MFCD24860030
O=C(C1C(C1(C)C)C(=O)O)Nc1ccc(cc1)c1n(nH)c(n1)C(C)C
ZINC000071287726
ZINC000071287730
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