Vitas-M small molecule compound
(4Z)-5-methyl-4-[4-(methylsulfanyl)benzylidene]-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK022861
SMILES CSc1ccc(cc1)/C=C\1/C(=NN(C1=O)c1ccccc1)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 C18H16N2OS MW 308.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2OS/c1-13-17(12-14-8-10-16(22-2)11-9-14)18(21)20(19-13)15-6-4-3-5-7-15/h3-12H,1-2H3/b17-12-InChIKey
FYEUCFWEMCBYCZ-ATVHPVEESA-NSynonyms
146795-14-4(4Z)5METHYL4((4METHYLSULFANYLPHENYL)METHYLIDENE)2PHENYLPYRAZOL3ONE
(4Z)5METHYL4(4(METHYLSULFANYL)BENZYLIDENE)2PHENYL24DIHYDRO3HPYRAZOL3ONE
146795144
CC1=NN(C(=O)C1=CC2=CC=C(C=C2)SC)C3=CC=CC=C3
CSc1ccc(cc1)C=C1C(=NN(C1=O)c1ccccc1)C
InChI=1SC18H16N2OSc11317(121481016(222)11914)18(21)20(1913)156435715h312H12H3b1712
MFCD02324043
STK022861
ZINC000004591205
ZINC04591205
ZINC4591205
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