Vitas-M small molecule compound
(4E)-4-{[(2-chlorobenzyl)amino]methylidene}-5-methyl-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK206740
SMILES CC1=NN(C(=O)/C/1=C/NCc1ccccc1Cl)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 C18H15ClN4O3 MW 370.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15ClN4O3/c1-12-16(11-20-10-13-4-2-3-5-17(13)19)18(24)22(21-12)14-6-8-15(9-7-14)23(25)26/h2-9,11,20H,10H2,1H3/b16-11+InChIKey
FOHRZZNHEHGCAI-LFIBNONCSA-NSynonyms
(4E)4(((2chlorobenzyl)amino)methylidene)5methyl2(4nitrophenyl)24dihydro3Hpyrazol3one
(4E)4(((2chlorophenyl)methylamino)methylidene)5methyl2(4nitrophenyl)pyrazol3one
4((((2CHLOROPHENYL)METHYL)AMINO)METHYLENE)3METHYL1(4NITROPHENYL)12DIAZOLIN5ONE
CC1=NN(C(=O)C1=CNCc1ccccc1Cl)c1ccc(cc1)(N+)(=O)(O)
CC1=NN(C(=O)C1=CNCC2=CC=CC=C2Cl)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC18H15ClN4O3c11216(11201013423517(13)19)18(24)22(2112)146815(9714)23(25)26h291120H10H21H3b1611+
MFCD04187606
ZINC000100429825
ZINC100429825
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