N-[4-(azepan-1-ylsulfonyl)phenyl]-4-methylsulfanyl-benzamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-methylsulfanyl-benzamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-methylsulfanyl-benzamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-4-(methylthio)benzamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-methylsulfanylbenzamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(methylthio)benzamide Formula: C20H24N2O3S2 MolecularWeight: 404.54616

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C20H24N2O3S2/c1-26-18-10-6-16(7-11-18)20(23)21-17-8-12-19(13-9-17)27(24,25)22-14-4-2-3-5-15-22/h6-13H,2-5,14-15H2,1H3,(H,21,23)