Vitas-M small molecule compound
(3aR,7aS)-2-[4-chloro-1-(4-fluorobenzyl)-1H-pyrazol-3-yl]hexahydro-1H-isoindole-1,3(2H)-dione
Catalog ID
STK311049
SMILES Fc1ccc(cc1)Cn1cc(c(n1)N1C(=O)[C@@H]2[C@H](C1=O)CCCC2)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 C18H17ClFN3O2 MW 361.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClFN3O2/c19-15-10-22(9-11-5-7-12(20)8-6-11)21-16(15)23-17(24)13-3-1-2-4-14(13)18(23)25/h5-8,10,13-14H,1-4,9H2/t13-,14+InChIKey
NQNUPEGKKNFVKV-OKILXGFUSA-NSynonyms
1212197-27-7(3aR7aS)2(4chloro1((4fluorophenyl)methyl)pyrazol3yl)3a45677ahexahydroisoindole13dione
(3aR7aS)2(4chloro1(4fluorobenzyl)1Hpyrazol3yl)hexahydro1Hisoindole13(2H)dione
1212197277
C1CCC2C(C1)C(=O)N(C2=O)C3=NN(C=C3Cl)CC4=CC=C(C=C4)F
Fc1ccc(cc1)Cn1cc(c(n1)N1C(=O)(C@@H)2(C@H)(C1=O)CCCC2)Cl
InChI=1SC18H17ClFN3O2c19151022(9115712(20)8611)2116(15)2317(24)13312414(13)18(23)25h58101314H149H2t1314+
MFCD04058963
ZINC000018166713
ZINC17821373
ZINC18166713
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