Vitas-M small molecule compound
methyl 2-{3-[(E)-(3-{2-[(3,4-dimethylphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoate
Catalog ID
STK157630
SMILES COC(=O)c1ccccc1n1c(C)cc(c1C)/C=C\1/SC(=O)N(C1=O)CC(=O)Nc1ccc(c(c1)C)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 C28H27N3O5S MW 517.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N3O5S/c1-16-10-11-21(12-17(16)2)29-25(32)15-30-26(33)24(37-28(30)35)14-20-13-18(3)31(19(20)4)23-9-7-6-8-22(23)27(34)36-5/h6-14H,15H2,1-5H3,(H,29,32)/b24-14+InChIKey
GETXLYNDHRRAPR-ZVHZXABRSA-NSynonyms
CC1=C(C=C(C=C1)NC(=O)CN2C(=O)C(=CC3=C(N(C(=C3)C)C4=CC=CC=C4C(=O)OC)C)SC2=O)C
COC(=O)c1ccccc1n1c(C)cc(c1C)C=C1SC(=O)N(C1=O)CC(=O)Nc1ccc(c(c1)C)C
InChI=1SC28H27N3O5Sc116101121(1217(16)2)2925(32)153026(33)24(3728(30)35)14201318(3)31(19(20)4)23976822(23)27(34)365h614H15H215H3(H2932)b2414+
METHYL2(3((3((N(34DIMETHYLPHENYL)CARBAMOYL)METHYL)24DIOXO(13THIAZOLIDIN5YLIDENE))METHYL)25DIMETHYLPYRROLYL)BENZOATE
METHYL2(3((E)(3(2((34DIMETHYLPHENYL)AMINO)2OXOETHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)25DIMETHYL1HPYRROL1YL)BENZOATE
METHYL2(3((E)(3(2(34DIMETHYLANILINO)2OXOETHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)25DIMETHYLPYRROL1YL)BENZOATE
MFCD03273774
ZINC000008722424
ZINC08722424
ZINC8722424
Check stock
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Check stock on Vitas-MAvailable files
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