Vitas-M small molecule compound

(4Z)-4-({5-[(4-methylphenyl)sulfanyl]furan-2-yl}methylidene)-1-phenylpyrazolidine-3,5-dione

Catalog ID
STK827972
SMILES Cc1ccc(cc1)Sc1ccc(o1)/C=C\1/C(=O)NN(C1=O)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 C21H16N2O3S MW 376.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N2O3S/c1-14-7-10-17(11-8-14)27-19-12-9-16(26-19)13-18-20(24)22-23(21(18)25)15-5-3-2-4-6-15/h2-13H,1H3,(H,22,24)/b18-13-
InChIKey
FUTXMERIQQASRF-AQTBWJFISA-N
Synonyms
383370-34-1
(4Z)1PHENYL4((5(PTOLYLTHIO)2FURYL)METHYLENE)PYRAZOLIDINE35QUINONE
(4Z)4((5((4methylphenyl)sulfanyl)furan2yl)methylidene)1phenylpyrazolidine35dione
(4Z)4((5((4METHYLPHENYL)THIO)2FURANYL)METHYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
(4Z)4((5(4METHYLPHENYL)SULFANYLFURAN2YL)METHYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
(Z)1phenyl4((5(ptolylthio)furan2yl)methylene)pyrazolidine35dione
1PHENYL4(1(5PTOLYLSULFANYLFURAN2YL)METH(Z)YLIDENE)PYRAZOLIDINE35DIONE
383370341
CC1=CC=C(C=C1)SC2=CC=C(O2)C=C3C(=O)NN(C3=O)C4=CC=CC=C4
Cc1ccc(cc1)Sc1ccc(o1)C=C1C(=O)NN(C1=O)c1ccccc1
InChI=1SC21H16N2O3Sc11471017(11814)271912916(2619)131820(24)2223(21(18)25)155324615h213H1H3(H2224)b1813
MFCD02109759
ZINC000013496523
ZINC13496523

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.