Vitas-M small molecule compound
4-methyl-N-[(5Z)-5-{[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzamide
Catalog ID
STK809167
SMILES Cc1ccc(cc1)C(=O)NN1C(=S)S/C(=C\c2cn(nc2c2ccc(cc2)C)c2ccccc2)/C1=O
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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 C28H22N4O2S2 MW 510.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22N4O2S2/c1-18-8-12-20(13-9-18)25-22(17-31(29-25)23-6-4-3-5-7-23)16-24-27(34)32(28(35)36-24)30-26(33)21-14-10-19(2)11-15-21/h3-17H,1-2H3,(H,30,33)/b24-16-InChIKey
VOBYEOAVBQKBFV-JLPGSUDCSA-NSynonyms
4methylN((5Z)5((3(4methylphenyl)1phenyl1Hpyrazol4yl)methylidene)4oxo2thioxo13thiazolidin3yl)benzamide
4METHYLN((5Z)5((3(4METHYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BENZAMIDE
CC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)NC(=O)C4=CC=C(C=C4)C)C5=CC=CC=C5
Cc1ccc(cc1)C(=O)NN1C(=S)SC(=Cc2cn(nc2c2ccc(cc2)C)c2ccccc2)C1=O
InChI=1SC28H22N4O2S2c11881220(13918)2522(1731(2925)236435723)162427(34)32(28(35)3624)3026(33)21141019(2)111521h317H12H3(H3033)b2416
MFCD03461231
ZINC000001449351
ZINC01449351
ZINC1449351
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