Vitas-M small molecule compound

(4E)-2-(3-chlorophenyl)-5-methyl-4-[(4H-1,2,4-triazol-4-ylamino)methylidene]-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STL383126
SMILES Clc1cccc(c1)N1N=C(/C(=C\Nn2cnnc2)/C1=O)C

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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 C13H11ClN6O MW 302.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11ClN6O/c1-9-12(6-17-19-7-15-16-8-19)13(21)20(18-9)11-4-2-3-10(14)5-11/h2-8,17H,1H3/b12-6+
InChIKey
WALBJLMFDKKBNP-WUXMJOGZSA-N
Synonyms

(4E)2(3CHLOROPHENYL)5METHYL4((124TRIAZOL4YLAMINO)METHYLIDENE)PYRAZOL3ONE
(4E)2(3chlorophenyl)5methyl4((4H124triazol4ylamino)methylidene)24dihydro3Hpyrazol3one
1(3CHLOROPHENYL)3METHYL4((124TRIAZOL4YLAMINO)METHYLENE)12DIAZOLIN5ONE
CC1=NN(C(=O)C1=CNN2C=NN=C2)C3=CC(=CC=C3)Cl
Clc1cccc(c1)N1N=C(C(=CNn2cnnc2)C1=O)C
InChI=1SC13H11ClN6Oc1912(6171971516819)13(21)20(189)1142310(14)511h2817H1H3b126+
MFCD00842308
ZINC000100535681
ZINC100535681

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Available files

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