Vitas-M small molecule compound
3-{[4-bromo-1-(4-chlorobenzyl)-1H-pyrazol-3-yl]carbamoyl}bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Catalog ID
STK315059
SMILES O=C(C1C2C=CC(C1C(=O)O)C2)Nc1nn(cc1Br)Cc1ccc(cc1)Cl
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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 C19H17BrClN3O3 MW 450.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17BrClN3O3/c20-14-9-24(8-10-1-5-13(21)6-2-10)23-17(14)22-18(25)15-11-3-4-12(7-11)16(15)19(26)27/h1-6,9,11-12,15-16H,7-8H2,(H,26,27)(H,22,23,25)InChIKey
VXRCLORIPTYVJG-UHFFFAOYSA-NSynonyms
1052555-97-11052555971
2((4bromo1((4chlorophenyl)methyl)pyrazol3yl)carbamoyl)bicyclo(221)hept5ene3carboxylicacid
3((4bromo1(4chlorobenzyl)1Hpyrazol3yl)carbamoyl)bicyclo(221)hept5ene2carboxylicacid
C1C2C=CC1C(C2C(=O)NC3=NN(C=C3Br)CC4=CC=C(C=C4)Cl)C(=O)O
InChI=1SC19H17BrClN3O3c2014924(8101513(21)6210)2317(14)2218(25)15113412(711)16(15)19(26)27h16911121516H78H2(H2627)(H222325)
MFCD06064291
ZINC000102023229
ZINC000239235418
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