Vitas-M small molecule compound
(3Z)-N'-[(E)-(3-nitrophenyl)methylidene]-2-oxo-3-(2'H-spiro[cyclopentane-1,3'-isoquinolin]-1'(4'H)-ylidene)propanehydrazide
Catalog ID
STL236251
SMILES O=C(C(=O)N/N=C/c1cccc(c1)[N+](=O)[O-])/C=C/1\NC2(CCCC2)Cc2c1cccc2
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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 C23H22N4O4 MW 418.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O4/c28-21(22(29)26-24-15-16-6-5-8-18(12-16)27(30)31)13-20-19-9-2-1-7-17(19)14-23(25-20)10-3-4-11-23/h1-2,5-9,12-13,15,25H,3-4,10-11,14H2,(H,26,29)/b20-13-,24-15+InChIKey
JSTWVPCHCFPVFI-MBUMNQNDSA-NSynonyms
667427-70-5(3Z)N((E)(3nitrophenyl)methylidene)2oxo3(2Hspiro(cyclopentane13isoquinolin)1(4H)ylidene)propanehydrazide
(3Z)N((E)(3NITROPHENYL)METHYLIDENEAMINO)2OXO3SPIRO(24DIHYDROISOQUINOLINE31CYCLOPENTANE)1YLIDENEPROPANAMIDE
(3ZNE)3(24dihydro1Hspiro(cyclopentane13isoquinolin)1ylidene)N(3nitrobenzylidene)2oxopropanehydrazide
667427705
C1CCC2(C1)CC3=CC=CC=C3C(=CC(=O)C(=O)NN=CC4=CC(=CC=C4)(N+)(=O)(O))N2
InChI=1SC23H22N4O4c2821(22(29)2624151665818(1216)27(30)31)132019921717(19)1423(2520)10341123h125912131525H34101114H2(H2629)b20132415+
MFCD03678108
O=C(C(=O)NN=Cc1cccc(c1)(N+)(=O)(O))C=C1NC2(CCCC2)Cc2c1cccc2
ZINC000005025058
ZINC36262564
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