Vitas-M small molecule compound
(3aR,7aS)-2-(1-benzyl-4-chloro-1H-pyrazol-3-yl)hexahydro-1H-isoindole-1,3(2H)-dione
Catalog ID
STK311104
SMILES O=C1[C@@H]2CCCC[C@@H]2C(=O)N1c1nn(cc1Cl)Cc1ccccc1
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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 C18H18ClN3O2 MW 343.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClN3O2/c19-15-11-21(10-12-6-2-1-3-7-12)20-16(15)22-17(23)13-8-4-5-9-14(13)18(22)24/h1-3,6-7,11,13-14H,4-5,8-10H2/t13-,14+InChIKey
HZQONKKMQXUELH-OKILXGFUSA-NSynonyms
1212401-68-7(3aR7aS)2(1benzyl4chloro1Hpyrazol3yl)hexahydro1Hisoindole13(2H)dione
(3aR7aS)2(1benzyl4chloropyrazol3yl)3a45677ahexahydroisoindole13dione
1212401687
C1CCC2C(C1)C(=O)N(C2=O)C3=NN(C=C3Cl)CC4=CC=CC=C4
InChI=1SC18H18ClN3O2c19151121(10126213712)2016(15)2217(23)13845914(13)18(22)24h1367111314H45810H2t1314+
MFCD04059119
O=C1(C@@H)2CCCC(C@@H)2C(=O)N1c1nn(cc1Cl)Cc1ccccc1
ZINC000018059079
ZINC18059079
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