Vitas-M small molecule compound
2-[(4-methylphenyl)amino]-2-oxoethyl 4-[(Z)-(3-{2-[(3-methylphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]benzoate
Catalog ID
STL297189
SMILES O=C(Nc1ccc(cc1)C)COC(=O)c1ccc(cc1)/C=C/1\SC(=O)N(C1=O)CC(=O)Nc1cccc(c1)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 C29H25N3O6S MW 543.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N3O6S/c1-18-6-12-22(13-7-18)30-26(34)17-38-28(36)21-10-8-20(9-11-21)15-24-27(35)32(29(37)39-24)16-25(33)31-23-5-3-4-19(2)14-23/h3-15H,16-17H2,1-2H3,(H,30,34)(H,31,33)/b24-15-InChIKey
LIJBAAUZDHQMEV-IWIPYMOSSA-NSynonyms
(2(4METHYLANILINO)2OXOETHYL)4((Z)(3(2(3METHYLANILINO)2OXOETHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)BENZOATE
2((4methylphenyl)amino)2oxoethyl4((Z)(3(2((3methylphenyl)amino)2oxoethyl)24dioxo13thiazolidin5ylidene)methyl)benzoate
CC1=CC=C(C=C1)NC(=O)COC(=O)C2=CC=C(C=C2)C=C3C(=O)N(C(=O)S3)CC(=O)NC4=CC=CC(=C4)C
InChI=1SC29H25N3O6Sc11861222(13718)3026(34)173828(36)2110820(91121)152427(35)32(29(37)3924)1625(33)312353419(2)1423h315H1617H212H3(H3034)(H3133)b2415
MFCD04087101
O=C(Nc1ccc(cc1)C)COC(=O)c1ccc(cc1)C=C1SC(=O)N(C1=O)CC(=O)Nc1cccc(c1)C
ZINC000100341348
ZINC100341348
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