1-(4-bromophenyl)-4-(2-thiophen-2-ylpyrrolidin-1-yl)butane-1,4-dione

Systemtic Name: 1-(4-bromophenyl)-4-(2-thiophen-2-ylpyrrolidin-1-yl)butane-1,4-dione Openeye Name: 1-(4-bromophenyl)-4-[2-(2-thienyl)pyrrolidin-1-yl]butane-1,4-dione CAS Name: 1-(4-bromophenyl)-4-(2-thiophen-2-yl-1-pyrrolidinyl)butane-1,4-dione IUPAC Name: 1-(4-bromophenyl)-4-(2-thiophen-2-ylpyrrolidin-1-yl)butane-1,4-dione Traditional Name: 1-(4-bromophenyl)-4-[2-(2-thienyl)pyrrolidino]butane-1,4-dione Formula: C18H18BrNO2S MolecularWeight: 392.31002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CCC(=O)C2=CC=C(C=C2)Br)C3=CC=CS3

Isomeric SMILES

C1CC(N(C1)C(=O)CCC(=O)C2=CC=C(C=C2)Br)C3=CC=CS3

InChI

InChI=1S/C18H18BrNO2S/c19-14-7-5-13(6-8-14)16(21)9-10-18(22)20-11-1-3-15(20)17-4-2-12-23-17/h2,4-8,12,15H,1,3,9-11H2