Vitas-M small molecule compound
(4E)-4-{2-[2-(morpholin-4-ylcarbonyl)phenyl]hydrazinylidene}-5-oxo-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbothioamide
Catalog ID
STK020555
SMILES NC(=S)N1N=C(/C(=N\Nc2ccccc2C(=O)N2CCOCC2)/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 C21H20N6O3S MW 436.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N6O3S/c22-21(31)27-20(29)18(17(25-27)14-6-2-1-3-7-14)24-23-16-9-5-4-8-15(16)19(28)26-10-12-30-13-11-26/h1-9,23H,10-13H2,(H2,22,31)/b24-18+InChIKey
SOCIZXRHMPELIZ-HKOYGPOVSA-NSynonyms
(4E)4((2(MORPHOLINE4CARBONYL)PHENYL)HYDRAZINYLIDENE)5OXO3PHENYLPYRAZOLE1CARBOTHIOAMIDE
(4E)4(2(2(MORPHOLIN4YLCARBONYL)PHENYL)HYDRAZINYLIDENE)5OXO3PHENYL45DIHYDRO1HPYRAZOLE1CARBOTHIOAMIDE
4((2(4MORPHOLINYLCARBONYL)PHENYL)HYDRAZONO)5OXO3PHENYL45DIHYDRO1HPYRAZOLE1CARBOTHIOAMIDE
C1COCCN1C(=O)C2=CC=CC=C2NN=C3C(=NN(C3=O)C(=S)N)C4=CC=CC=C4
InChI=1SC21H20N6O3Sc2221(31)2720(29)18(17(2527)146213714)242316954815(16)19(28)26101230131126h1923H1013H2(H22231)b2418+
MFCD01008342
NC(=S)N1N=C(C(=NNc2ccccc2C(=O)N2CCOCC2)C1=O)c1ccccc1
STK020555
ZINC000100005971
ZINC13555448
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Check stock on Vitas-MAvailable files
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