N-[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]-2-(4-tert-butylphenoxy)ethanamide

Systemtic Name: N-[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]-2-(4-tert-butylphenoxy)ethanamide Openeye Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-2-(4-tert-butylphenoxy)acetamide CAS Name: N-[2-(1-azepanyl)-2-(3-thiophenyl)ethyl]-2-(4-tert-butylphenoxy)acetamide IUPAC Name: N-[2-(azepan-1-yl)-2-thiophen-3-ylethyl]-2-(4-tert-butylphenoxy)acetamide Traditional Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-2-(4-tert-butylphenoxy)acetamide Formula: C24H34N2O2S MolecularWeight: 414.60396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC(=O)NCC(C2=CSC=C2)N3CCCCCC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC(=O)NCC(C2=CSC=C2)N3CCCCCC3

InChI

InChI=1S/C24H34N2O2S/c1-24(2,3)20-8-10-21(11-9-20)28-17-23(27)25-16-22(19-12-15-29-18-19)26-13-6-4-5-7-14-26/h8-12,15,18,22H,4-7,13-14,16-17H2,1-3H3,(H,25,27)