Vitas-M small molecule compound

methyl 4-[({3-[2-(3,4-dimethoxyphenyl)ethyl]-1-ethyl-5-oxo-2-thioxoimidazolidin-4-yl}acetyl)amino]benzoate

Catalog ID
STK012408
SMILES CCN1C(=S)N(C(C1=O)CC(=O)Nc1ccc(cc1)C(=O)OC)CCc1ccc(c(c1)OC)OC

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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 C25H29N3O6S MW 499.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N3O6S/c1-5-27-23(30)19(15-22(29)26-18-9-7-17(8-10-18)24(31)34-4)28(25(27)35)13-12-16-6-11-20(32-2)21(14-16)33-3/h6-11,14,19H,5,12-13,15H2,1-4H3,(H,26,29)
InChIKey
ZYGLQSKLKKDJKG-UHFFFAOYSA-N
Synonyms
473568-73-9
473568739
CCN1C(=O)C(N(C1=S)CCC2=CC(=C(C=C2)OC)OC)CC(=O)NC3=CC=C(C=C3)C(=O)OC
CCN1C(=S)N(C(C1=O)CC(=O)Nc1ccc(cc1)C(=O)OC)CCc1ccc(c(c1)OC)OC
InChI=1SC25H29N3O6Sc152723(30)19(1522(29)26189717(81018)24(31)344)28(25(27)35)13121661120(322)21(1416)333h6111419H5121315H214H3(H2629)
METHYL4(((3(2(34DIMETHOXYPHENYL)ETHYL)1ETHYL5OXO2THIOXOIMIDAZOLIDIN4YL)ACETYL)AMINO)BENZOATE
METHYL4((2(3(2(34DIMETHOXYPHENYL)ETHYL)1ETHYL5OXO2SULFANYLIDENEIMIDAZOLIDIN4YL)ACETYL)AMINO)BENZOATE
methyl4(2(3(34dimethoxyphenethyl)1ethyl5oxo2thioxoimidazolidin4yl)acetamido)benzoate
MFCD02142680
STK012408
ZINC000008817669
ZINC000008817670

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.