Vitas-M small molecule compound

(4E)-5-methyl-2-(4-methylphenyl)-4-[(1-methyl-1H-pyrazol-4-yl)methylidene]-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STL391662
SMILES Cc1ccc(cc1)N1N=C(/C(=C\c2cnn(c2)C)/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 C16H16N4O MW 280.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O/c1-11-4-6-14(7-5-11)20-16(21)15(12(2)18-20)8-13-9-17-19(3)10-13/h4-10H,1-3H3/b15-8+
InChIKey
NGGQFMBKQXMTJJ-OVCLIPMQSA-N
Synonyms
1005672-36-5
(4E)5methyl2(4methylphenyl)4((1methyl1Hpyrazol4yl)methylidene)24dihydro3Hpyrazol3one
(4E)5METHYL2(4METHYLPHENYL)4((1METHYLPYRAZOL4YL)METHYLIDENE)PYRAZOL3ONE
1005672365
CC1=CC=C(C=C1)N2C(=O)C(=CC3=CN(N=C3)C)C(=N2)C
Cc1ccc(cc1)N1N=C(C(=Cc2cnn(c2)C)C1=O)C
InChI=1SC16H16N4Oc1114614(7511)2016(21)15(12(2)1820)81391719(3)1013h410H13H3b158+
MFCD04050488
ZINC000006788395
ZINC06788395
ZINC6788395

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Available files

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