N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[(4-bromophenyl)amino]ethanamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[(4-bromophenyl)amino]ethanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(4-bromoanilino)acetamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-2-(4-bromoanilino)acetamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(4-bromoanilino)acetamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(4-bromoanilino)acetamide Formula: C20H24BrN3O3S MolecularWeight: 466.39186

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CNC3=CC=C(C=C3)Br

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CNC3=CC=C(C=C3)Br

InChI

InChI=1S/C20H24BrN3O3S/c21-16-8-10-17(11-9-16)22-15-20(25)23-18-6-5-7-19(14-18)28(26,27)24-12-3-1-2-4-13-24/h5-11,14,22H,1-4,12-13,15H2,(H,23,25)