2,4-bis(oxidanylidene)-5-phenethyl-3-(3-phenyl-1-sulfanyl-propyl)imidazolidine-1-carboxylic acid

Systemtic Name: 2,4-bis(oxidanylidene)-5-phenethyl-3-(3-phenyl-1-sulfanyl-propyl)imidazolidine-1-carboxylic acid Openeye Name: 2,4-dioxo-5-phenethyl-3-(3-phenyl-1-sulfanyl-propyl)imidazolidine-1-carboxylic acid CAS Name: 3-(1-mercapto-3-phenylpropyl)-2,4-dioxo-5-phenethyl-1-imidazolidinecarboxylic acid IUPAC Name: 2,4-dioxo-5-phenethyl-3-(3-phenyl-1-sulfanylpropyl)imidazolidine-1-carboxylic acid Traditional Name: 2,4-diketo-3-(1-mercapto-3-phenyl-propyl)-5-phenethyl-imidazolidine-1-carboxylic acid Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2C(=O)N(C(=O)N2C(=O)O)C(CCC3=CC=CC=C3)S

Isomeric SMILES

C1=CC=C(C=C1)CCC2C(=O)N(C(=O)N2C(=O)O)C(CCC3=CC=CC=C3)S

InChI

InChI=1S/C21H22N2O4S/c24-19-17(13-11-15-7-3-1-4-8-15)22(21(26)27)20(25)23(19)18(28)14-12-16-9-5-2-6-10-16/h1-10,17-18,28H,11-14H2,(H,26,27)