2-[(4-ethanoyl-3-methyl-phenoxy)methyl]-N-[(2-fluorophenyl)methyl]morpholine-4-carbothioamide

Systemtic Name: 2-[(4-ethanoyl-3-methyl-phenoxy)methyl]-N-[(2-fluorophenyl)methyl]morpholine-4-carbothioamide Openeye Name: 2-[(4-acetyl-3-methyl-phenoxy)methyl]-N-[(2-fluorophenyl)methyl]morpholine-4-carbothioamide CAS Name: 2-[(4-acetyl-3-methylphenoxy)methyl]-N-[(2-fluorophenyl)methyl]-4-morpholinecarbothioamide IUPAC Name: 2-[(4-acetyl-3-methylphenoxy)methyl]-N-[(2-fluorophenyl)methyl]morpholine-4-carbothioamide Traditional Name: 2-[(4-acetyl-3-methyl-phenoxy)methyl]-N-(2-fluorobenzyl)morpholine-4-carbothioamide Formula: C22H25FN2O3S MolecularWeight: 416.508903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2CN(CCO2)C(=S)NCC3=CC=CC=C3F)C(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2CN(CCO2)C(=S)NCC3=CC=CC=C3F)C(=O)C

InChI

InChI=1S/C22H25FN2O3S/c1-15-11-18(7-8-20(15)16(2)26)28-14-19-13-25(9-10-27-19)22(29)24-12-17-5-3-4-6-21(17)23/h3-8,11,19H,9-10,12-14H2,1-2H3,(H,24,29)