Vitas-M small molecule compound
1-[2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-2-(4-hydroxyphthalazin-1-yl)ethanone
Catalog ID
STL411290
SMILES O=C(N1CCCC1c1nc2c([nH]1)cccc2)Cc1nnc(c2c1cccc2)O
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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 C21H19N5O2 MW 373.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N5O2/c27-19(12-17-13-6-1-2-7-14(13)21(28)25-24-17)26-11-5-10-18(26)20-22-15-8-3-4-9-16(15)23-20/h1-4,6-9,18H,5,10-12H2,(H,22,23)(H,25,28)InChIKey
ATOHTICXNBODQM-UHFFFAOYSA-NSynonyms
1(2(1Hbenzimidazol2yl)pyrrolidin1yl)2(4hydroxyphthalazin1yl)ethanone
4(2(2(1Hbenzimidazol2yl)pyrrolidin1yl)2oxoethyl)2Hphthalazin1one
C1CC(N(C1)C(=O)CC2=NNC(=O)C3=CC=CC=C32)C4=NC5=CC=CC=C5N4
InChI=1SC21H19N5O2c2719(121713612714(13)21(28)252417)261151018(26)202215834916(15)2320h146918H51012H2(H2223)(H2528)
MFCD30706639
O=C(N1CCCC1c1nc2c((nH)1)cccc2)Cc1nnc(c2c1cccc2)O
ZINC000011585044
ZINC000011585048
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