3-(azepan-1-ylsulfonyl)-4-ethoxy-N-(phenylmethyl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-ethoxy-N-(phenylmethyl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-benzyl-4-ethoxy-benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-ethoxy-N-(phenylmethyl)benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-benzyl-4-ethoxybenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-benzyl-4-ethoxy-benzamide Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NCC2=CC=CC=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NCC2=CC=CC=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C22H28N2O4S/c1-2-28-20-13-12-19(22(25)23-17-18-10-6-5-7-11-18)16-21(20)29(26,27)24-14-8-3-4-9-15-24/h5-7,10-13,16H,2-4,8-9,14-15,17H2,1H3,(H,23,25)