Vitas-M small molecule compound
4-(4-methylphenyl)-4a,5,6,7,8,8a-hexahydrophthalazin-1(2H)-one
Catalog ID
STK358894
SMILES O=C1NN=C(C2C1CCCC2)c1ccc(cc1)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 C15H18N2O MW 242.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18N2O/c1-10-6-8-11(9-7-10)14-12-4-2-3-5-13(12)15(18)17-16-14/h6-9,12-13H,2-5H2,1H3,(H,17,18)InChIKey
CAGGMZIQVSXHRG-UHFFFAOYSA-NSynonyms
4(4methylphenyl)4a56788ahexahydro2Hphthalazin1one
4(4methylphenyl)4a56788ahexahydrophthalazin1(2H)one
CC1=CC=C(C=C1)C2=NNC(=O)C3C2CCCC3
InChI=1SC15H18N2Oc1106811(9710)1412423513(12)15(18)171614h691213H25H21H3(H1718)
MFCD10487636
ZINC000005794187
ZINC000006814426
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