Vitas-M small molecule compound
(3aR,7aS)-2-[1-(3-chlorobenzyl)-1H-pyrazol-3-yl]hexahydro-1H-isoindole-1,3(2H)-dione
Catalog ID
STK311139
SMILES Clc1cccc(c1)Cn1ccc(n1)N1C(=O)[C@@H]2[C@H](C1=O)CCCC2
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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/c19-13-5-3-4-12(10-13)11-21-9-8-16(20-21)22-17(23)14-6-1-2-7-15(14)18(22)24/h3-5,8-10,14-15H,1-2,6-7,11H2/t14-,15+InChIKey
SACUEVMLIJULPV-GASCZTMLSA-NSynonyms
1212125-90-0(3aR7aS)2(1((3chlorophenyl)methyl)pyrazol3yl)3a45677ahexahydroisoindole13dione
(3aR7aS)2(1(3chlorobenzyl)1Hpyrazol3yl)hexahydro1Hisoindole13(2H)dione
1212125900
C1CCC2C(C1)C(=O)N(C2=O)C3=NN(C=C3)CC4=CC(=CC=C4)Cl
Clc1cccc(c1)Cn1ccc(n1)N1C(=O)(C@@H)2(C@H)(C1=O)CCCC2
InChI=1SC18H18ClN3O2c191353412(1013)11219816(2021)2217(23)14612715(14)18(22)24h358101415H126711H2t1415+
MFCD04059222
ZINC000017071779
ZINC17071779
ZINC18166759
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