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

Systemtic Name: 2-[4-(4-butoxyphenyl)carbonylpiperazin-1-yl]-1-thiophen-2-yl-ethanone Openeye Name: 2-[4-(4-butoxybenzoyl)piperazin-1-yl]-1-(2-thienyl)ethanone CAS Name: 2-[4-[(4-butoxyphenyl)-oxomethyl]-1-piperazinyl]-1-thiophen-2-ylethanone IUPAC Name: 2-[4-(4-butoxybenzoyl)piperazin-1-yl]-1-thiophen-2-ylethanone Traditional Name: 2-[4-(4-butoxybenzoyl)piperazino]-1-(2-thienyl)ethanone Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC(=O)C3=CC=CS3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC(=O)C3=CC=CS3

InChI

InChI=1S/C21H26N2O3S/c1-2-3-14-26-18-8-6-17(7-9-18)21(25)23-12-10-22(11-13-23)16-19(24)20-5-4-15-27-20/h4-9,15H,2-3,10-14,16H2,1H3