1-phenethyl-4-[3-[(1-propanoyl-2,3-dihydroindol-5-yl)sulfonyl]propanoyl]piperazine-2,6-dione

Systemtic Name: 1-phenethyl-4-[3-[(1-propanoyl-2,3-dihydroindol-5-yl)sulfonyl]propanoyl]piperazine-2,6-dione Openeye Name: 1-phenethyl-4-[3-(1-propanoylindolin-5-yl)sulfonylpropanoyl]piperazine-2,6-dione CAS Name: 4-[1-oxo-3-[[1-(1-oxopropyl)-2,3-dihydroindol-5-yl]sulfonyl]propyl]-1-phenethylpiperazine-2,6-dione IUPAC Name: 1-phenethyl-4-[3-[(1-propanoyl-2,3-dihydroindol-5-yl)sulfonyl]propanoyl]piperazine-2,6-dione Traditional Name: 1-phenethyl-4-[3-(1-propionylindolin-5-yl)sulfonylpropanoyl]piperazine-2,6-quinone Formula: C26H29N3O6S MolecularWeight: 511.58996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C1C=CC(=C2)S(=O)(=O)CCC(=O)N3CC(=O)N(C(=O)C3)CCC4=CC=CC=C4

Isomeric SMILES

CCC(=O)N1CCC2=C1C=CC(=C2)S(=O)(=O)CCC(=O)N3CC(=O)N(C(=O)C3)CCC4=CC=CC=C4

InChI

InChI=1S/C26H29N3O6S/c1-2-23(30)28-14-11-20-16-21(8-9-22(20)28)36(34,35)15-12-24(31)27-17-25(32)29(26(33)18-27)13-10-19-6-4-3-5-7-19/h3-9,16H,2,10-15,17-18H2,1H3