5,5-diphenyl-3-[(4-thiophen-2-ylcarbonylpiperazin-1-ium-1-yl)methyl]imidazolidine-2,4-dione

Systemtic Name: 5,5-diphenyl-3-[(4-thiophen-2-ylcarbonylpiperazin-1-ium-1-yl)methyl]imidazolidine-2,4-dione Openeye Name: 5,5-diphenyl-3-[[4-(thiophene-2-carbonyl)piperazin-1-ium-1-yl]methyl]imidazolidine-2,4-dione CAS Name: 3-[[4-[oxo(thiophen-2-yl)methyl]-1-piperazin-1-iumyl]methyl]-5,5-diphenylimidazolidine-2,4-dione IUPAC Name: 5,5-diphenyl-3-[[4-(thiophene-2-carbonyl)piperazin-1-ium-1-yl]methyl]imidazolidine-2,4-dione Traditional Name: 5,5-diphenyl-3-[[4-(2-thenoyl)piperazin-1-ium-1-yl]methyl]hydantoin Formula: C25H25N4O3S+ MolecularWeight: 461.556

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CN2C(=O)C(NC2=O)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)C5=CC=CS5

Isomeric SMILES

C1CN(CC[NH+]1CN2C(=O)C(NC2=O)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)C5=CC=CS5

InChI

InChI=1S/C25H24N4O3S/c30-22(21-12-7-17-33-21)28-15-13-27(14-16-28)18-29-23(31)25(26-24(29)32,19-8-3-1-4-9-19)20-10-5-2-6-11-20/h1-12,17H,13-16,18H2,(H,26,32)/p+1