Vitas-M small molecule compound

methyl (3-benzyl-5-{2-[(4-methoxyphenyl)amino]-2-oxoethyl}-4-oxo-2-thioxoimidazolidin-1-yl)acetate

Catalog ID
STK056874
SMILES COC(=O)CN1C(=S)N(C(=O)C1CC(=O)Nc1ccc(cc1)OC)Cc1ccccc1

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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 C22H23N3O5S MW 441.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O5S/c1-29-17-10-8-16(9-11-17)23-19(26)12-18-21(28)25(13-15-6-4-3-5-7-15)22(31)24(18)14-20(27)30-2/h3-11,18H,12-14H2,1-2H3,(H,23,26)
InChIKey
JMIOZQIBNKSPPD-UHFFFAOYSA-N
Synonyms

(3BENZYL5((4METHOXYPHENYLCARBAMOYL)METHYL)4OXO2THIOXOIMIDAZOLIDIN1YL)ACETICACIDMETHYLESTER
COC(=O)CN1C(=S)N(C(=O)C1CC(=O)Nc1ccc(cc1)OC)Cc1ccccc1
COC1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CC(=O)OC)CC3=CC=CC=C3
InChI=1SC22H23N3O5Sc1291710816(91117)2319(26)121821(28)25(13156435715)22(31)24(18)1420(27)302h31118H1214H212H3(H2326)
METHYL(3BENZYL5(2((4METHOXYPHENYL)AMINO)2OXOETHYL)4OXO2THIOXOIMIDAZOLIDIN1YL)ACETATE
METHYL2(3BENZYL5(2(4METHOXYANILINO)2OXOETHYL)4OXO2SULFANYLIDENEIMIDAZOLIDIN1YL)ACETATE
MFCD02143162
STK056874
ZINC000000872299
ZINC000000872300
ZINC00872299

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Available files

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