3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(1-phenylethyl)propanamide

Systemtic Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(1-phenylethyl)propanamide Openeye Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(1-phenylethyl)propanamide CAS Name: 3-[4-(1-azepanylsulfonyl)phenyl]-N-(1-phenylethyl)propanamide IUPAC Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(1-phenylethyl)propanamide Traditional Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(1-phenylethyl)propionamide Formula: C23H30N2O3S MolecularWeight: 414.5609

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C23H30N2O3S/c1-19(21-9-5-4-6-10-21)24-23(26)16-13-20-11-14-22(15-12-20)29(27,28)25-17-7-2-3-8-18-25/h4-6,9-12,14-15,19H,2-3,7-8,13,16-18H2,1H3,(H,24,26)