3-(azepan-1-ylsulfonyl)-N-[(4-ethoxyphenyl)methyl]-4-methyl-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[(4-ethoxyphenyl)methyl]-4-methyl-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[(4-ethoxyphenyl)methyl]-4-methyl-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[(4-ethoxyphenyl)methyl]-4-methylbenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[(4-ethoxyphenyl)methyl]-4-methylbenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(4-ethoxybenzyl)-4-methyl-benzamide Formula: C23H30N2O4S MolecularWeight: 430.5603

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N2O4S/c1-3-29-21-12-9-19(10-13-21)17-24-23(26)20-11-8-18(2)22(16-20)30(27,28)25-14-6-4-5-7-15-25/h8-13,16H,3-7,14-15,17H2,1-2H3,(H,24,26)