Vitas-M small molecule compound
(3aR,7aS)-2-[1-(2,4-dichlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]hexahydro-1H-isoindole-1,3(2H)-dione
Catalog ID
STK311162
SMILES Clc1ccc(c(c1)Cl)Cn1nc(c(c1C)N1C(=O)[C@@H]2[C@H](C1=O)CCCC2)C
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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 C20H21Cl2N3O2 MW 406.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21Cl2N3O2/c1-11-18(25-19(26)15-5-3-4-6-16(15)20(25)27)12(2)24(23-11)10-13-7-8-14(21)9-17(13)22/h7-9,15-16H,3-6,10H2,1-2H3/t15-,16+InChIKey
CVDGVBAVCVSWMQ-IYBDPMFKSA-NSynonyms
1212411-53-4(3aR7aS)2(1((24dichlorophenyl)methyl)35dimethylpyrazol4yl)3a45677ahexahydroisoindole13dione
(3aR7aS)2(1(24dichlorobenzyl)35dimethyl1Hpyrazol4yl)hexahydro1Hisoindole13(2H)dione
1212411534
CC1=C(C(=NN1CC2=C(C=C(C=C2)Cl)Cl)C)N3C(=O)C4CCCCC4C3=O
Clc1ccc(c(c1)Cl)Cn1nc(c(c1C)N1C(=O)(C@@H)2(C@H)(C1=O)CCCC2)C
InChI=1SC20H21Cl2N3O2c11118(2519(26)15534616(15)20(25)27)12(2)24(2311)10137814(21)917(13)22h791516H3610H212H3t1516+
MFCD04059274
ZINC000018114342
ZINC18114342
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