5-(azepan-1-ylsulfonyl)-N-[(4-butoxyphenyl)methyl]-2-chloranyl-benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-[(4-butoxyphenyl)methyl]-2-chloranyl-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-[(4-butoxyphenyl)methyl]-2-chloro-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-[(4-butoxyphenyl)methyl]-2-chlorobenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-[(4-butoxyphenyl)methyl]-2-chlorobenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-(4-butoxybenzyl)-2-chloro-benzamide Formula: C24H31ClN2O4S MolecularWeight: 479.03194

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)Cl

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)Cl

InChI

InChI=1S/C24H31ClN2O4S/c1-2-3-16-31-20-10-8-19(9-11-20)18-26-24(28)22-17-21(12-13-23(22)25)32(29,30)27-14-6-4-5-7-15-27/h8-13,17H,2-7,14-16,18H2,1H3,(H,26,28)