N-[4-[(4-quinolin-8-ylsulfonyl-1,4-diazepan-1-yl)methyl]phenyl]ethanamide

Systemtic Name: N-[4-[(4-quinolin-8-ylsulfonyl-1,4-diazepan-1-yl)methyl]phenyl]ethanamide Openeye Name: N-[4-[[4-(8-quinolylsulfonyl)-1,4-diazepan-1-yl]methyl]phenyl]acetamide CAS Name: N-[4-[[4-(8-quinolinylsulfonyl)-1,4-diazepan-1-yl]methyl]phenyl]acetamide IUPAC Name: N-[4-[(4-quinolin-8-ylsulfonyl-1,4-diazepan-1-yl)methyl]phenyl]acetamide Traditional Name: N-[4-[[4-(8-quinolylsulfonyl)-1,4-diazepan-1-yl]methyl]phenyl]acetamide Formula: C23H26N4O3S MolecularWeight: 438.54254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)CN2CCCN(CC2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)CN2CCCN(CC2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C23H26N4O3S/c1-18(28)25-21-10-8-19(9-11-21)17-26-13-4-14-27(16-15-26)31(29,30)22-7-2-5-20-6-3-12-24-23(20)22/h2-3,5-12H,4,13-17H2,1H3,(H,25,28)