2-[4-(4-tert-butylphenyl)carbonylpiperazin-1-yl]-1-thiophen-2-yl-ethanone

Systemtic Name: 2-[4-(4-tert-butylphenyl)carbonylpiperazin-1-yl]-1-thiophen-2-yl-ethanone Openeye Name: 2-[4-(4-tert-butylbenzoyl)piperazin-1-yl]-1-(2-thienyl)ethanone CAS Name: 2-[4-[(4-tert-butylphenyl)-oxomethyl]-1-piperazinyl]-1-thiophen-2-ylethanone IUPAC Name: 2-[4-(4-tert-butylbenzoyl)piperazin-1-yl]-1-thiophen-2-ylethanone Traditional Name: 2-[4-(4-tert-butylbenzoyl)piperazino]-1-(2-thienyl)ethanone Formula: C21H26N2O2S MolecularWeight: 370.50834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)CC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)CC(=O)C3=CC=CS3

InChI

InChI=1S/C21H26N2O2S/c1-21(2,3)17-8-6-16(7-9-17)20(25)23-12-10-22(11-13-23)15-18(24)19-5-4-14-26-19/h4-9,14H,10-13,15H2,1-3H3