1-[2-(2-benzamido-3-phenyl-propanoyl)sulfanylpropanoyl]-2,5-dihydropyrrole-2-carboxylic acid

Systemtic Name: 1-[2-(2-benzamido-3-phenyl-propanoyl)sulfanylpropanoyl]-2,5-dihydropyrrole-2-carboxylic acid Openeye Name: 1-[2-(2-benzamido-3-phenyl-propanoyl)sulfanylpropanoyl]-2,5-dihydropyrrole-2-carboxylic acid CAS Name: 1-[2-[(2-benzamido-1-oxo-3-phenylpropyl)thio]-1-oxopropyl]-2,5-dihydropyrrole-2-carboxylic acid IUPAC Name: 1-[2-(2-benzamido-3-phenylpropanoyl)sulfanylpropanoyl]-2,5-dihydropyrrole-2-carboxylic acid Traditional Name: 1-[2-[(2-benzamido-3-phenyl-propanoyl)thio]propanoyl]-3-pyrroline-2-carboxylic acid Formula: C24H24N2O5S MolecularWeight: 452.52276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CC=CC1C(=O)O)SC(=O)C(CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)N1CC=CC1C(=O)O)SC(=O)C(CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H24N2O5S/c1-16(22(28)26-14-8-13-20(26)23(29)30)32-24(31)19(15-17-9-4-2-5-10-17)25-21(27)18-11-6-3-7-12-18/h2-13,16,19-20H,14-15H2,1H3,(H,25,27)(H,29,30)