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

Systemtic Name: 2-[(4-fluorophenyl)methyl]-5-(2-phenylpyrrolidin-1-yl)carbonyl-thiomorpholin-3-one Openeye Name: 2-[(4-fluorophenyl)methyl]-5-(2-phenylpyrrolidine-1-carbonyl)thiomorpholin-3-one CAS Name: 2-[(4-fluorophenyl)methyl]-5-[oxo-(2-phenyl-1-pyrrolidinyl)methyl]-3-thiomorpholinone IUPAC Name: 2-[(4-fluorophenyl)methyl]-5-(2-phenylpyrrolidine-1-carbonyl)thiomorpholin-3-one Traditional Name: 2-(4-fluorobenzyl)-5-(2-phenylpyrrolidine-1-carbonyl)thiomorpholin-3-one Formula: C22H23FN2O2S MolecularWeight: 398.493623

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2CSC(C(=O)N2)CC3=CC=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

C1CC(N(C1)C(=O)C2CSC(C(=O)N2)CC3=CC=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C22H23FN2O2S/c23-17-10-8-15(9-11-17)13-20-21(26)24-18(14-28-20)22(27)25-12-4-7-19(25)16-5-2-1-3-6-16/h1-3,5-6,8-11,18-20H,4,7,12-14H2,(H,24,26)