1-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]-4-thiophen-2-yl-butane-1,4-dione

Systemtic Name: 1-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]-4-thiophen-2-yl-butane-1,4-dione Openeye Name: 1-[4-(4-ethylbenzoyl)piperazin-1-yl]-4-(2-thienyl)butane-1,4-dione CAS Name: 1-[4-[(4-ethylphenyl)-oxomethyl]-1-piperazinyl]-4-thiophen-2-ylbutane-1,4-dione IUPAC Name: 1-[4-(4-ethylbenzoyl)piperazin-1-yl]-4-thiophen-2-ylbutane-1,4-dione Traditional Name: 1-[4-(4-ethylbenzoyl)piperazino]-4-(2-thienyl)butane-1,4-dione Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)CCC(=O)C3=CC=CS3

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)CCC(=O)C3=CC=CS3

InChI

InChI=1S/C21H24N2O3S/c1-2-16-5-7-17(8-6-16)21(26)23-13-11-22(12-14-23)20(25)10-9-18(24)19-4-3-15-27-19/h3-8,15H,2,9-14H2,1H3