Vitas-M small molecule compound
(4Z)-4-[(benzylamino)methylidene]-5-methyl-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK261692
SMILES CC1=NN(C(=O)/C/1=C\NCc1ccccc1)c1ccc(cc1)[N+](=O)[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 C18H16N4O3 MW 336.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N4O3/c1-13-17(12-19-11-14-5-3-2-4-6-14)18(23)21(20-13)15-7-9-16(10-8-15)22(24)25/h2-10,12,19H,11H2,1H3/b17-12-InChIKey
HMVMHPWIBFYPOS-ATVHPVEESA-NSynonyms
(4Z)4((BENZYLAMINO)METHYLIDENE)5METHYL2(4NITROPHENYL)24DIHYDRO3HPYRAZOL3ONE
(4Z)4((BENZYLAMINO)METHYLIDENE)5METHYL2(4NITROPHENYL)PYRAZOL3ONE
(Z)4((benzylamino)methylene)3methyl1(4nitrophenyl)1Hpyrazol5(4H)one
3METHYL1(4NITROPHENYL)4((BENZYLAMINO)METHYLENE)12DIAZOLIN5ONE
CC1=NN(C(=O)C1=CNCc1ccccc1)c1ccc(cc1)(N+)(=O)(O)
CC1=NN(C(=O)C1=CNCC2=CC=CC=C2)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC18H16N4O3c11317(121911145324614)18(23)21(2013)157916(10815)22(24)25h2101219H11H21H3b1712
MFCD01562897
ZINC000004785738
ZINC04785738
ZINC4785738
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