Vitas-M small molecule compound
(4E)-2-(3-chlorophenyl)-4-{[(2-methoxy-4-nitrophenyl)amino]methylidene}-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL295200
SMILES COc1cc(ccc1N/C=C/1\C(=NN(C1=O)c1cccc(c1)Cl)C)[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 C18H15ClN4O4 MW 386.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15ClN4O4/c1-11-15(18(24)22(21-11)13-5-3-4-12(19)8-13)10-20-16-7-6-14(23(25)26)9-17(16)27-2/h3-10,20H,1-2H3/b15-10+InChIKey
YIOJYQDWEVBMMC-XNTDXEJSSA-NSynonyms
(4E)2(3chlorophenyl)4(((2methoxy4nitrophenyl)amino)methylidene)5methyl24dihydro3Hpyrazol3one
(4E)2(3CHLOROPHENYL)4((2METHOXY4NITROANILINO)METHYLIDENE)5METHYLPYRAZOL3ONE
CC1=NN(C(=O)C1=CNC2=C(C=C(C=C2)(N+)(=O)(O))OC)C3=CC(=CC=C3)Cl
COc1cc(ccc1NC=C1C(=NN(C1=O)c1cccc(c1)Cl)C)(N+)(=O)(O)
InChI=1SC18H15ClN4O4c11115(18(24)22(2111)1353412(19)813)1020167614(23(25)26)917(16)272h31020H12H3b1510+
MFCD01019877
ZINC000100535672
ZINC100535672
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