Vitas-M small molecule compound
(3aR,7aS)-2-[1-(2-methylbenzyl)-1H-pyrazol-3-yl]hexahydro-1H-isoindole-1,3(2H)-dione
Catalog ID
STK310947
SMILES O=C1N(c2ccn(n2)Cc2ccccc2C)C(=O)[C@@H]2[C@H]1CCCC2
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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 C19H21N3O2 MW 323.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N3O2/c1-13-6-2-3-7-14(13)12-21-11-10-17(20-21)22-18(23)15-8-4-5-9-16(15)19(22)24/h2-3,6-7,10-11,15-16H,4-5,8-9,12H2,1H3/t15-,16+InChIKey
HMULXVWJKCMVLF-IYBDPMFKSA-NSynonyms
1212122-87-6(3aR7aS)2(1((2methylphenyl)methyl)pyrazol3yl)3a45677ahexahydroisoindole13dione
(3aR7aS)2(1(2methylbenzyl)1Hpyrazol3yl)hexahydro1Hisoindole13(2H)dione
1212122876
CC1=CC=CC=C1CN2C=CC(=N2)N3C(=O)C4CCCCC4C3=O
InChI=1SC19H21N3O2c113623714(13)1221111017(2021)2218(23)15845916(15)19(22)24h236710111516H458912H21H3t1516+
MFCD04136735
O=C1N(c2ccn(n2)Cc2ccccc2C)C(=O)(C@@H)2(C@H)1CCCC2
ZINC000017056581
ZINC17056581
ZINC18166688
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