Vitas-M small molecule compound
(3aR,7aS)-2-[1-(2,6-dichlorobenzyl)-1H-1,2,4-triazol-3-yl]hexahydro-1H-isoindole-1,3(2H)-dione
Catalog ID
STK311228
SMILES O=C1[C@@H]2CCCC[C@@H]2C(=O)N1c1ncn(n1)Cc1c(Cl)cccc1Cl
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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 C17H16Cl2N4O2 MW 379.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16Cl2N4O2/c18-13-6-3-7-14(19)12(13)8-22-9-20-17(21-22)23-15(24)10-4-1-2-5-11(10)16(23)25/h3,6-7,9-11H,1-2,4-5,8H2/t10-,11+InChIKey
OZPLUZSQFXTPKX-PHIMTYICSA-NSynonyms
1052581-63-1(3aR7aS)2(1((26dichlorophenyl)methyl)124triazol3yl)3a45677ahexahydroisoindole13dione
(3aR7aS)2(1(26dichlorobenzyl)1H124triazol3yl)hexahydro1Hisoindole13(2H)dione
1052581631
C1CCC2C(C1)C(=O)N(C2=O)C3=NN(C=N3)CC4=C(C=CC=C4Cl)Cl
InChI=1SC17H16Cl2N4O2c181363714(19)12(13)82292017(2122)2315(24)10412511(10)16(23)25h367911H12458H2t1011+
MFCD04059455
O=C1(C@@H)2CCCC(C@@H)2C(=O)N1c1ncn(n1)Cc1c(Cl)cccc1Cl
ZINC000006828648
ZINC06828648
ZINC6828648
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