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

Systemtic Name: 2-[(4-fluorophenyl)methyl]-5-[2-(4-methoxyphenyl)pyrrolidin-1-yl]carbonyl-thiomorpholin-3-one Openeye Name: 2-[(4-fluorophenyl)methyl]-5-[2-(4-methoxyphenyl)pyrrolidine-1-carbonyl]thiomorpholin-3-one CAS Name: 2-[(4-fluorophenyl)methyl]-5-[[2-(4-methoxyphenyl)-1-pyrrolidinyl]-oxomethyl]-3-thiomorpholinone IUPAC Name: 2-[(4-fluorophenyl)methyl]-5-[2-(4-methoxyphenyl)pyrrolidine-1-carbonyl]thiomorpholin-3-one Traditional Name: 2-(4-fluorobenzyl)-5-[2-(4-methoxyphenyl)pyrrolidine-1-carbonyl]thiomorpholin-3-one Formula: C23H25FN2O3S MolecularWeight: 428.519603

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCN2C(=O)C3CSC(C(=O)N3)CC4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC=C(C=C1)C2CCCN2C(=O)C3CSC(C(=O)N3)CC4=CC=C(C=C4)F

InChI

InChI=1S/C23H25FN2O3S/c1-29-18-10-6-16(7-11-18)20-3-2-12-26(20)23(28)19-14-30-21(22(27)25-19)13-15-4-8-17(24)9-5-15/h4-11,19-21H,2-3,12-14H2,1H3,(H,25,27)