Vitas-M small molecule compound
(4Z)-5-amino-4-(2,6-dichlorobenzylidene)-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL191429
SMILES NC1=NN(C(=O)/C/1=C\c1c(Cl)cccc1Cl)c1ccccc1
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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 C16H11Cl2N3O MW 332.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11Cl2N3O/c17-13-7-4-8-14(18)11(13)9-12-15(19)20-21(16(12)22)10-5-2-1-3-6-10/h1-9H,(H2,19,20)/b12-9-InChIKey
DDNDMBVVURVXBI-XFXZXTDPSA-NSynonyms
(4Z)5amino4((26dichlorophenyl)methylidene)2phenylpyrazol3one
(4Z)5amino4(26dichlorobenzylidene)2phenyl24dihydro3Hpyrazol3one
C1=CC=C(C=C1)N2C(=O)C(=CC3=C(C=CC=C3Cl)Cl)C(=N2)N
InChI=1SC16H11Cl2N3Oc171374814(18)11(13)91215(19)2021(16(12)22)105213610h19H(H21920)b129
MFCD22390321
NC1=NN(C(=O)C1=Cc1c(Cl)cccc1Cl)c1ccccc1
ZINC000072332471
ZINC72332471
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