Vitas-M small molecule compound

methyl 3-({[1-(4-methylphenyl)-2,5-dioxo-3-(thiophen-2-ylmethyl)imidazolidin-4-yl]acetyl}amino)benzoate

Catalog ID
STL481931
SMILES COC(=O)c1cccc(c1)NC(=O)CC1C(=O)N(C(=O)N1Cc1cccs1)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 C25H23N3O5S MW 477.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O5S/c1-16-8-10-19(11-9-16)28-23(30)21(27(25(28)32)15-20-7-4-12-34-20)14-22(29)26-18-6-3-5-17(13-18)24(31)33-2/h3-13,21H,14-15H2,1-2H3,(H,26,29)
InChIKey
QSMKJXKNVDMNJB-UHFFFAOYSA-N
Synonyms

CC1=CC=C(C=C1)N2C(=O)C(N(C2=O)CC3=CC=CS3)CC(=O)NC4=CC=CC(=C4)C(=O)OC
InChI=1SC25H23N3O5Sc11681019(11916)2823(30)21(27(25(28)32)152074123420)1422(29)261863517(1318)24(31)332h31321H1415H212H3(H2629)
methyl3(((1(4methylphenyl)25dioxo3(thiophen2ylmethyl)imidazolidin4yl)acetyl)amino)benzoate
METHYL3((2(1(4METHYLPHENYL)25DIOXO3(2THIENYLMETHYL)4IMIDAZOLIDINYL)ACETYL)AMINO)BENZOATE
METHYL3((2(1(4METHYLPHENYL)25DIOXO3(THIOPHEN2YLMETHYL)IMIDAZOLIDIN4YL)ACETYL)AMINO)BENZOATE
MFCD06164612
ZINC000016957244
ZINC000016957245

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Available files

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