2-bromanyl-N-[3-(2,3-dihydroindol-1-yl)propyl]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-bromanyl-N-[3-(2,3-dihydroindol-1-yl)propyl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-bromo-N-(3-indolin-1-ylpropyl)-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-bromo-N-[3-(2,3-dihydroindol-1-yl)propyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-bromo-N-[3-(2,3-dihydroindol-1-yl)propyl]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-bromo-N-(3-indolin-1-ylpropyl)-5-pyrrolidinosulfonyl-benzamide Formula: C22H26BrN3O3S MolecularWeight: 492.42914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)NCCCN3CCC4=CC=CC=C43

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)NCCCN3CCC4=CC=CC=C43

InChI

InChI=1S/C22H26BrN3O3S/c23-20-9-8-18(30(28,29)26-13-3-4-14-26)16-19(20)22(27)24-11-5-12-25-15-10-17-6-1-2-7-21(17)25/h1-2,6-9,16H,3-5,10-15H2,(H,24,27)