6-[(4-fluorophenyl)methyl]-5-oxidanylidene-N-(3,4,5-trimethoxyphenyl)thiomorpholine-3-carboxamide

Systemtic Name: 6-[(4-fluorophenyl)methyl]-5-oxidanylidene-N-(3,4,5-trimethoxyphenyl)thiomorpholine-3-carboxamide Openeye Name: 6-[(4-fluorophenyl)methyl]-5-oxo-N-(3,4,5-trimethoxyphenyl)thiomorpholine-3-carboxamide CAS Name: 6-[(4-fluorophenyl)methyl]-5-oxo-N-(3,4,5-trimethoxyphenyl)-3-thiomorpholinecarboxamide IUPAC Name: 6-[(4-fluorophenyl)methyl]-5-oxo-N-(3,4,5-trimethoxyphenyl)thiomorpholine-3-carboxamide Traditional Name: 6-(4-fluorobenzyl)-5-keto-N-(3,4,5-trimethoxyphenyl)thiomorpholine-3-carboxamide Formula: C21H23FN2O5S MolecularWeight: 434.481123

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=O)C2CSC(C(=O)N2)CC3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=O)C2CSC(C(=O)N2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C21H23FN2O5S/c1-27-16-9-14(10-17(28-2)19(16)29-3)23-20(25)15-11-30-18(21(26)24-15)8-12-4-6-13(22)7-5-12/h4-7,9-10,15,18H,8,11H2,1-3H3,(H,23,25)(H,24,26)