N-[2-(azepan-1-yl)-2-thiophen-2-yl-ethyl]-2-bromanyl-benzamide

Systemtic Name: N-[2-(azepan-1-yl)-2-thiophen-2-yl-ethyl]-2-bromanyl-benzamide Openeye Name: N-[2-(azepan-1-yl)-2-(2-thienyl)ethyl]-2-bromo-benzamide CAS Name: N-[2-(1-azepanyl)-2-thiophen-2-ylethyl]-2-bromobenzamide IUPAC Name: N-[2-(azepan-1-yl)-2-thiophen-2-ylethyl]-2-bromobenzamide Traditional Name: N-[2-(azepan-1-yl)-2-(2-thienyl)ethyl]-2-bromo-benzamide Formula: C19H23BrN2OS MolecularWeight: 407.36772

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(CNC(=O)C2=CC=CC=C2Br)C3=CC=CS3

Isomeric SMILES

C1CCCN(CC1)C(CNC(=O)C2=CC=CC=C2Br)C3=CC=CS3

InChI

InChI=1S/C19H23BrN2OS/c20-16-9-4-3-8-15(16)19(23)21-14-17(18-10-7-13-24-18)22-11-5-1-2-6-12-22/h3-4,7-10,13,17H,1-2,5-6,11-12,14H2,(H,21,23)