3-(azepan-1-ylsulfonyl)-N-[(2S)-2-phenylpropyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[(2S)-2-phenylpropyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[(2S)-2-phenylpropyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[(2S)-2-phenylpropyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[(2S)-2-phenylpropyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-[(2S)-2-phenylpropyl]benzamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCCCC2)C3=CC=CC=C3

Isomeric SMILES

C[C@H](CNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCCCC2)C3=CC=CC=C3

InChI

InChI=1S/C22H28N2O3S/c1-18(19-10-5-4-6-11-19)17-23-22(25)20-12-9-13-21(16-20)28(26,27)24-14-7-2-3-8-15-24/h4-6,9-13,16,18H,2-3,7-8,14-15,17H2,1H3,(H,23,25)/t18-/m1/s1