4,5-bis[ethanethioyl(phenylcarbonyl)amino]pentanoic acid

Systemtic Name: 4,5-bis[ethanethioyl(phenylcarbonyl)amino]pentanoic acid Openeye Name: 4,5-bis[benzoyl(ethanethioyl)amino]pentanoic acid CAS Name: 4,5-bis[benzoyl(1-sulfanylideneethyl)amino]pentanoic acid IUPAC Name: 4,5-bis[benzoyl(ethanethioyl)amino]pentanoic acid Traditional Name: 4,5-bis[benzoyl(thioacetyl)amino]valeric acid Formula: C23H24N2O4S2 MolecularWeight: 456.57766

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Descriptors Computed from Structure

Canonical SMILES:

CC(=S)N(CC(CCC(=O)O)N(C(=S)C)C(=O)C1=CC=CC=C1)C(=O)C2=CC=CC=C2

Isomeric SMILES

CC(=S)N(CC(CCC(=O)O)N(C(=S)C)C(=O)C1=CC=CC=C1)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C23H24N2O4S2/c1-16(30)24(22(28)18-9-5-3-6-10-18)15-20(13-14-21(26)27)25(17(2)31)23(29)19-11-7-4-8-12-19/h3-12,20H,13-15H2,1-2H3,(H,26,27)