Vitas-M small molecule compound
4-[(E)-(3-{[(4-methylphenyl)carbonyl]amino}-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 3-methoxybenzoate
Catalog ID
STK809181
SMILES COc1cccc(c1)C(=O)Oc1ccc(cc1)/C=C\1/SC(=S)N(C1=O)NC(=O)c1ccc(cc1)C
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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 C26H20N2O5S2 MW 504.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20N2O5S2/c1-16-6-10-18(11-7-16)23(29)27-28-24(30)22(35-26(28)34)14-17-8-12-20(13-9-17)33-25(31)19-4-3-5-21(15-19)32-2/h3-15H,1-2H3,(H,27,29)/b22-14+InChIKey
KBXVWKBMGHNMEK-HYARGMPZSA-NSynonyms
(4((E)(3((4METHYLBENZOYL)AMINO)4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PHENYL)3METHOXYBENZOATE
4((E)(3(((4methylphenyl)carbonyl)amino)4oxo2thioxo13thiazolidin5ylidene)methyl)phenyl3methoxybenzoate
CC1=CC=C(C=C1)C(=O)NN2C(=O)C(=CC3=CC=C(C=C3)OC(=O)C4=CC(=CC=C4)OC)SC2=S
COc1cccc(c1)C(=O)Oc1ccc(cc1)C=C1SC(=S)N(C1=O)NC(=O)c1ccc(cc1)C
InChI=1SC26H20N2O5S2c11661018(11716)23(29)272824(30)22(3526(28)34)141781220(13917)3325(31)1943521(1519)322h315H12H3(H2729)b2214+
MFCD03461241
ZINC000016790596
ZINC16790596
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