Vitas-M small molecule compound
1-ethyl-4-[2-(2-methylpropyl)-2H-1,3-benzoxazin-3(4H)-yl]-1H-pyrazole-3-carboxylic acid
Catalog ID
STK352385
SMILES CCn1nc(c(c1)N1Cc2ccccc2OC1CC(C)C)C(=O)O
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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 C18H23N3O3 MW 329.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N3O3/c1-4-20-11-14(17(19-20)18(22)23)21-10-13-7-5-6-8-15(13)24-16(21)9-12(2)3/h5-8,11-12,16H,4,9-10H2,1-3H3,(H,22,23)InChIKey
PCFMEKMDBVYODO-UHFFFAOYSA-NSynonyms
1171592-34-91171592349
1ETHYL4(2(2METHYLPROPYL)(2H4HBENZO(E)13OXAZAPERHYDROIN3YL))PYRAZOLE3CARBOXYLICACID
1ethyl4(2(2methylpropyl)24dihydro13benzoxazin3yl)pyrazole3carboxylicacid
1ethyl4(2(2methylpropyl)2H13benzoxazin3(4H)yl)1Hpyrazole3carboxylicacid
CCN1C=C(C(=N1)C(=O)O)N2CC3=CC=CC=C3OC2CC(C)C
InChI=1SC18H23N3O3c14201114(17(1920)18(22)23)211013756815(13)2416(21)912(2)3h58111216H4910H213H3(H2223)
MFCD09473412
ZINC000012397225
ZINC000012397227
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