Vitas-M small molecule compound
S-{1-[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]-3-oxo-3-phenylpropyl} ethanethioate
Catalog ID
STK820773
SMILES Cc1ccc(cc1)c1nn(cc1C(CC(=O)c1ccccc1)SC(=O)C)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 C27H24N2O2S MW 440.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24N2O2S/c1-19-13-15-22(16-14-19)27-24(18-29(28-27)23-11-7-4-8-12-23)26(32-20(2)30)17-25(31)21-9-5-3-6-10-21/h3-16,18,26H,17H2,1-2H3InChIKey
NVTRBEREWPIMKL-UHFFFAOYSA-NSynonyms
313049-82-0313049820
CC1=CC=C(C=C1)C2=NN(C=C2C(CC(=O)C3=CC=CC=C3)SC(=O)C)C4=CC=CC=C4
InChI=1SC27H24N2O2Sc119131522(161419)2724(1829(2827)23117481223)26(3220(2)30)1725(31)2195361021h3161826H17H212H3
MFCD01952581
S(1(3(4methylphenyl)1phenyl1Hpyrazol4yl)3oxo3phenylpropyl)ethanethioate
S(1(3(4METHYLPHENYL)1PHENYLPYRAZOL4YL)3OXO3PHENYLPROPYL)ETHANETHIOATE
S(3oxo3phenyl1(1phenyl3(ptolyl)1Hpyrazol4yl)propyl)ethanethioate
ZINC000001168201
ZINC000001168202
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