Vitas-M small molecule compound
3-{[1-(naphthalen-1-ylmethyl)-1H-pyrazol-4-yl]carbamoyl}bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Catalog ID
STK315088
SMILES O=C(C1C2C=CC(C1C(=O)O)C2)Nc1cnn(c1)Cc1cccc2c1cccc2
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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 C23H21N3O3 MW 387.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O3/c27-22(20-15-8-9-16(10-15)21(20)23(28)29)25-18-11-24-26(13-18)12-17-6-3-5-14-4-1-2-7-19(14)17/h1-9,11,13,15-16,20-21H,10,12H2,(H,25,27)(H,28,29)InChIKey
WBIAQXPKFLTJSW-UHFFFAOYSA-NSynonyms
1052556-36-11052556361
2((1(naphthalen1ylmethyl)pyrazol4yl)carbamoyl)bicyclo(221)hept5ene3carboxylicacid
3((1(naphthalen1ylmethyl)1Hpyrazol4yl)carbamoyl)bicyclo(221)hept5ene2carboxylicacid
C1C2C=CC1C(C2C(=O)NC3=CN(N=C3)CC4=CC=CC5=CC=CC=C54)C(=O)O
InChI=1SC23H21N3O3c2722(20158916(1015)21(20)23(28)29)2518112426(1318)121763514412719(14)17h19111315162021H1012H2(H2527)(H2829)
MFCD07618181
ZINC000102023301
ZINC000239235492
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