N-[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]-4-phenyl-butanamide

Systemtic Name: N-[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]-4-phenyl-butanamide Openeye Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-4-phenyl-butanamide CAS Name: N-[2-(1-azepanyl)-2-(3-thiophenyl)ethyl]-4-phenylbutanamide IUPAC Name: N-[2-(azepan-1-yl)-2-thiophen-3-ylethyl]-4-phenylbutanamide Traditional Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-4-phenyl-butyramide Formula: C22H30N2OS MolecularWeight: 370.5514

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(CNC(=O)CCCC2=CC=CC=C2)C3=CSC=C3

Isomeric SMILES

C1CCCN(CC1)C(CNC(=O)CCCC2=CC=CC=C2)C3=CSC=C3

InChI

InChI=1S/C22H30N2OS/c25-22(12-8-11-19-9-4-3-5-10-19)23-17-21(20-13-16-26-18-20)24-14-6-1-2-7-15-24/h3-5,9-10,13,16,18,21H,1-2,6-8,11-12,14-15,17H2,(H,23,25)