3-(azepan-1-ylsulfonyl)-N-[4-[(2S)-butan-2-yl]phenyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[4-[(2S)-butan-2-yl]phenyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[4-[(1S)-1-methylpropyl]phenyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[4-[(2S)-butan-2-yl]phenyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[4-[(2S)-butan-2-yl]phenyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-[4-[(1S)-1-methylpropyl]phenyl]benzamide Formula: C23H30N2O3S MolecularWeight: 414.5609

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C23H30N2O3S/c1-3-18(2)19-11-13-21(14-12-19)24-23(26)20-9-8-10-22(17-20)29(27,28)25-15-6-4-5-7-16-25/h8-14,17-18H,3-7,15-16H2,1-2H3,(H,24,26)/t18-/m0/s1