Vitas-M small molecule compound
3-({1-ethyl-3-[(furan-2-ylmethyl)carbamoyl]-1H-pyrazol-4-yl}carbamoyl)-7-(propan-2-ylidene)bicyclo[2.2.1]heptane-2-carboxylic acid
Catalog ID
STK445888
SMILES CCn1cc(c(n1)C(=O)NCc1ccco1)NC(=O)C1C(C(=O)O)C2C(=C(C)C)C1CC2
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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 C23H28N4O5 MW 440.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N4O5/c1-4-27-11-16(20(26-27)22(29)24-10-13-6-5-9-32-13)25-21(28)18-14-7-8-15(17(14)12(2)3)19(18)23(30)31/h5-6,9,11,14-15,18-19H,4,7-8,10H2,1-3H3,(H,24,29)(H,25,28)(H,30,31)InChIKey
HGEZERJUKQNCAJ-UHFFFAOYSA-NSynonyms
2((1ethyl3(furan2ylmethylcarbamoyl)pyrazol4yl)carbamoyl)7propan2ylidenebicyclo(221)heptane3carboxylicacid
3((1ethyl3((furan2ylmethyl)carbamoyl)1Hpyrazol4yl)carbamoyl)7(propan2ylidene)bicyclo(221)heptane2carboxylicacid
3(N(1ETHYL3(N(2FURYLMETHYL)CARBAMOYL)PYRAZOL4YL)CARBAMOYL)7(METHYLETHYLIDENE)BICYCLO(221)HEPTANE2CARBOXYLICACID
CCN1C=C(C(=N1)C(=O)NCC2=CC=CO2)NC(=O)C3C4CCC(C3C(=O)O)C4=C(C)C
InChI=1SC23H28N4O5c14271116(20(2627)22(29)2410136593213)2521(28)18147815(17(14)12(2)3)19(18)23(30)31h5691114151819H47810H213H3(H2429)(H2528)(H3031)
MFCD04058311
ZINC000102643995
ZINC000102644004
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