N-[2-(azepan-1-ylcarbonyl)phenyl]-4-(2-phenylsulfanylethoxy)benzamide

Systemtic Name: N-[2-(azepan-1-ylcarbonyl)phenyl]-4-(2-phenylsulfanylethoxy)benzamide Openeye Name: N-[2-(azepane-1-carbonyl)phenyl]-4-(2-phenylsulfanylethoxy)benzamide CAS Name: N-[2-[1-azepanyl(oxo)methyl]phenyl]-4-[2-(phenylthio)ethoxy]benzamide IUPAC Name: N-[2-(azepane-1-carbonyl)phenyl]-4-(2-phenylsulfanylethoxy)benzamide Traditional Name: N-[2-(azepane-1-carbonyl)phenyl]-4-[2-(phenylthio)ethoxy]benzamide Formula: C28H30N2O3S MolecularWeight: 474.6144

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC=CC=C2NC(=O)C3=CC=C(C=C3)OCCSC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC=CC=C2NC(=O)C3=CC=C(C=C3)OCCSC4=CC=CC=C4

InChI

InChI=1S/C28H30N2O3S/c31-27(22-14-16-23(17-15-22)33-20-21-34-24-10-4-3-5-11-24)29-26-13-7-6-12-25(26)28(32)30-18-8-1-2-9-19-30/h3-7,10-17H,1-2,8-9,18-21H2,(H,29,31)