Vitas-M small molecule compound
(4Z)-4-{2-[4-chloro-2-(phenylcarbonyl)phenyl]hydrazinylidene}-5-oxo-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbothioamide
Catalog ID
STK096387
SMILES Clc1ccc(c(c1)C(=O)c1ccccc1)N/N=C/1\C(=O)N(N=C1c1ccccc1)C(=S)N
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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 C23H16ClN5O2S MW 461.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16ClN5O2S/c24-16-11-12-18(17(13-16)21(30)15-9-5-2-6-10-15)26-27-20-19(14-7-3-1-4-8-14)28-29(22(20)31)23(25)32/h1-13,26H,(H2,25,32)/b27-20-InChIKey
CPKUPFJWTAHYKW-OOAXWGSJSA-NSynonyms
(4Z)4((2BENZOYL4CHLOROPHENYL)HYDRAZINYLIDENE)5OXO3PHENYLPYRAZOLE1CARBOTHIOAMIDE
(4Z)4(2(4CHLORO2(PHENYLCARBONYL)PHENYL)HYDRAZINYLIDENE)5OXO3PHENYL45DIHYDRO1HPYRAZOLE1CARBOTHIOAMIDE
C1=CC=C(C=C1)C2=NN(C(=O)C2=NNC3=C(C=C(C=C3)Cl)C(=O)C4=CC=CC=C4)C(=S)N
Clc1ccc(c(c1)C(=O)c1ccccc1)NN=C1C(=O)N(N=C1c1ccccc1)C(=S)N
InChI=1SC23H16ClN5O2Sc2416111218(17(1316)21(30)1595261015)26272019(147314814)2829(22(20)31)23(25)32h11326H(H22532)b2720
MFCD01418627
STK096387
ZINC000013573762
ZINC100530568
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