Vitas-M small molecule compound
2-[3-(1H-benzotriazol-1-ylcarbonyl)phenyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Catalog ID
STK008728
SMILES O=C1N(c2cccc(c2)C(=O)n2nnc3c2cccc3)C(=O)C2C1CC=CC2
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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 C21H16N4O3 MW 372.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N4O3/c26-19(25-18-11-4-3-10-17(18)22-23-25)13-6-5-7-14(12-13)24-20(27)15-8-1-2-9-16(15)21(24)28/h1-7,10-12,15-16H,8-9H2InChIKey
RZUKPCHUSKQAOE-UHFFFAOYSA-NSynonyms
2(3(1HBENZOTRIAZOL1YLCARBONYL)PHENYL)3A477ATETRAHYDRO1HISOINDOLE13(2H)DIONE
2(3(BENZOTRIAZOLE1CARBONYL)PHENYL)3A477ATETRAHYDROISOINDOLE13DIONE
2(3(BENZOTRIAZOLYLCARBONYL)PHENYL)473A7ATETRAHYDROISOINDOLE13DIONE
C1C=CCC2C1C(=O)N(C2=O)C3=CC=CC(=C3)C(=O)N4C5=CC=CC=C5N=N4
InChI=1SC21H16N4O3c2619(251811431017(18)222325)1365714(1213)2420(27)15812916(15)21(24)28h1710121516H89H2
MFCD07189879
O=C1N(c2cccc(c2)C(=O)n2nnc3c2cccc3)C(=O)C2C1CC=CC2
STK008728
ZINC000012360492
ZINC000101384335
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