4-[3-(4-methylphenyl)sulfonylpropanoyl]-1-phenethyl-piperazine-2,6-dione

Systemtic Name: 4-[3-(4-methylphenyl)sulfonylpropanoyl]-1-phenethyl-piperazine-2,6-dione Openeye Name: 1-phenethyl-4-[3-(p-tolylsulfonyl)propanoyl]piperazine-2,6-dione CAS Name: 4-[3-(4-methylphenyl)sulfonyl-1-oxopropyl]-1-phenethylpiperazine-2,6-dione IUPAC Name: 4-[3-(4-methylphenyl)sulfonylpropanoyl]-1-phenethylpiperazine-2,6-dione Traditional Name: 1-phenethyl-4-(3-tosylpropanoyl)piperazine-2,6-quinone Formula: C22H24N2O5S MolecularWeight: 428.50136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N2CC(=O)N(C(=O)C2)CCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N2CC(=O)N(C(=O)C2)CCC3=CC=CC=C3

InChI

InChI=1S/C22H24N2O5S/c1-17-7-9-19(10-8-17)30(28,29)14-12-20(25)23-15-21(26)24(22(27)16-23)13-11-18-5-3-2-4-6-18/h2-10H,11-16H2,1H3