Vitas-M small molecule compound
(4Z)-4-(1-{[3-(1H-imidazol-1-yl)propyl]amino}ethylidene)-5-methyl-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK014672
SMILES C/C(=C/1\C(=NN(C1=O)c1ccc(cc1)[N+](=O)[O-])C)/NCCCn1cncc1
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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 C18H20N6O3 MW 368.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N6O3/c1-13(20-8-3-10-22-11-9-19-12-22)17-14(2)21-23(18(17)25)15-4-6-16(7-5-15)24(26)27/h4-7,9,11-12,20H,3,8,10H2,1-2H3/b17-13-InChIKey
DYHFVSHAAZMQOT-LGMDPLHJSA-NSynonyms
(4Z)4(1((3(1HIMIDAZOL1YL)PROPYL)AMINO)ETHYLIDENE)5METHYL2(4NITROPHENYL)24DIHYDRO3HPYRAZOL3ONE
(4Z)4(1(3IMIDAZOL1YLPROPYLAMINO)ETHYLIDENE)5METHYL2(4NITROPHENYL)PYRAZOL3ONE
(E)4(1((3(1Himidazol1yl)propyl)amino)ethylidene)3methyl1(4nitrophenyl)1Hpyrazol5(4H)one
4(((3IMIDAZOLYLPROPYL)AMINO)ETHYLIDENE)3METHYL1(4NITROPHENYL)12DIAZOLIN5ONE
CC(=C1C(=NN(C1=O)c1ccc(cc1)(N+)(=O)(O))C)NCCCn1cncc1
CC1=NN(C(=O)C1=C(C)NCCCN2C=CN=C2)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC18H20N6O3c113(20831022119191222)1714(2)2123(18(17)25)154616(7515)24(26)27h479111220H3810H212H3b1713
MFCD02044267
STK014672
ZINC000100095544
ZINC100095544
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