2-[(2-fluorophenyl)methyl]-5-[4-(phenylcarbonyl)piperazin-1-yl]carbonyl-thiomorpholin-3-one

Systemtic Name: 2-[(2-fluorophenyl)methyl]-5-[4-(phenylcarbonyl)piperazin-1-yl]carbonyl-thiomorpholin-3-one Openeye Name: 5-(4-benzoylpiperazine-1-carbonyl)-2-[(2-fluorophenyl)methyl]thiomorpholin-3-one CAS Name: 5-[(4-benzoyl-1-piperazinyl)-oxomethyl]-2-[(2-fluorophenyl)methyl]-3-thiomorpholinone IUPAC Name: 5-(4-benzoylpiperazine-1-carbonyl)-2-[(2-fluorophenyl)methyl]thiomorpholin-3-one Traditional Name: 5-(4-benzoylpiperazine-1-carbonyl)-2-(2-fluorobenzyl)thiomorpholin-3-one Formula: C23H24FN3O3S MolecularWeight: 441.518363

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2CSC(C(=O)N2)CC3=CC=CC=C3F)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)C2CSC(C(=O)N2)CC3=CC=CC=C3F)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H24FN3O3S/c24-18-9-5-4-8-17(18)14-20-21(28)25-19(15-31-20)23(30)27-12-10-26(11-13-27)22(29)16-6-2-1-3-7-16/h1-9,19-20H,10-15H2,(H,25,28)