4-[5-(2,3-dihydroindol-1-ylsulfonyl)-2-fluoranyl-phenyl]carbonyl-1-phenethyl-piperazine-2,6-dione

Systemtic Name: 4-[5-(2,3-dihydroindol-1-ylsulfonyl)-2-fluoranyl-phenyl]carbonyl-1-phenethyl-piperazine-2,6-dione Openeye Name: 4-(2-fluoro-5-indolin-1-ylsulfonyl-benzoyl)-1-phenethyl-piperazine-2,6-dione CAS Name: 4-[[5-(2,3-dihydroindol-1-ylsulfonyl)-2-fluorophenyl]-oxomethyl]-1-phenethylpiperazine-2,6-dione IUPAC Name: 4-[5-(2,3-dihydroindol-1-ylsulfonyl)-2-fluorobenzoyl]-1-phenethylpiperazine-2,6-dione Traditional Name: 4-(2-fluoro-5-indolin-1-ylsulfonyl-benzoyl)-1-phenethyl-piperazine-2,6-quinone Formula: C27H24FN3O5S MolecularWeight: 521.559963

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)S(=O)(=O)C3=CC(=C(C=C3)F)C(=O)N4CC(=O)N(C(=O)C4)CCC5=CC=CC=C5

Isomeric SMILES

C1CN(C2=CC=CC=C21)S(=O)(=O)C3=CC(=C(C=C3)F)C(=O)N4CC(=O)N(C(=O)C4)CCC5=CC=CC=C5

InChI

InChI=1S/C27H24FN3O5S/c28-23-11-10-21(37(35,36)31-15-13-20-8-4-5-9-24(20)31)16-22(23)27(34)29-17-25(32)30(26(33)18-29)14-12-19-6-2-1-3-7-19/h1-11,16H,12-15,17-18H2