N-[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]-2-phenoxy-benzamide

Systemtic Name: N-[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]-2-phenoxy-benzamide Openeye Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-2-phenoxy-benzamide CAS Name: N-[2-(1-azepanyl)-2-(3-thiophenyl)ethyl]-2-phenoxybenzamide IUPAC Name: N-[2-(azepan-1-yl)-2-thiophen-3-ylethyl]-2-phenoxybenzamide Traditional Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-2-phenoxy-benzamide Formula: C25H28N2O2S MolecularWeight: 420.56702

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(CNC(=O)C2=CC=CC=C2OC3=CC=CC=C3)C4=CSC=C4

Isomeric SMILES

C1CCCN(CC1)C(CNC(=O)C2=CC=CC=C2OC3=CC=CC=C3)C4=CSC=C4

InChI

InChI=1S/C25H28N2O2S/c28-25(22-12-6-7-13-24(22)29-21-10-4-3-5-11-21)26-18-23(20-14-17-30-19-20)27-15-8-1-2-9-16-27/h3-7,10-14,17,19,23H,1-2,8-9,15-16,18H2,(H,26,28)