N-[4-(azepan-1-yl)phenyl]-2-(4-bromophenyl)sulfanyl-ethanamide

Systemtic Name: N-[4-(azepan-1-yl)phenyl]-2-(4-bromophenyl)sulfanyl-ethanamide Openeye Name: N-[4-(azepan-1-yl)phenyl]-2-(4-bromophenyl)sulfanyl-acetamide CAS Name: N-[4-(1-azepanyl)phenyl]-2-[(4-bromophenyl)thio]acetamide IUPAC Name: N-[4-(azepan-1-yl)phenyl]-2-(4-bromophenyl)sulfanylacetamide Traditional Name: N-[4-(azepan-1-yl)phenyl]-2-[(4-bromophenyl)thio]acetamide Formula: C20H23BrN2OS MolecularWeight: 419.37842

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)CSC3=CC=C(C=C3)Br

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)CSC3=CC=C(C=C3)Br

InChI

InChI=1S/C20H23BrN2OS/c21-16-5-11-19(12-6-16)25-15-20(24)22-17-7-9-18(10-8-17)23-13-3-1-2-4-14-23/h5-12H,1-4,13-15H2,(H,22,24)