4-[(3-fluorophenyl)methyl]-3-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]piperazin-2-one

Systemtic Name: 4-[(3-fluorophenyl)methyl]-3-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]piperazin-2-one Openeye Name: 4-[(3-fluorophenyl)methyl]-3-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]piperazin-2-one CAS Name: 4-[(3-fluorophenyl)methyl]-3-[2-oxo-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]ethyl]-2-piperazinone IUPAC Name: 4-[(3-fluorophenyl)methyl]-3-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]piperazin-2-one Traditional Name: 4-(3-fluorobenzyl)-3-[2-keto-2-[4-(2-thenoyl)piperazino]ethyl]piperazin-2-one Formula: C22H25FN4O3S MolecularWeight: 444.522303

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C(=O)N1)CC(=O)N2CCN(CC2)C(=O)C3=CC=CS3)CC4=CC(=CC=C4)F

Isomeric SMILES

C1CN(C(C(=O)N1)CC(=O)N2CCN(CC2)C(=O)C3=CC=CS3)CC4=CC(=CC=C4)F

InChI

InChI=1S/C22H25FN4O3S/c23-17-4-1-3-16(13-17)15-27-7-6-24-21(29)18(27)14-20(28)25-8-10-26(11-9-25)22(30)19-5-2-12-31-19/h1-5,12-13,18H,6-11,14-15H2,(H,24,29)