N-(2,5-dimethoxyphenyl)-6-[(4-fluorophenyl)methyl]-5-oxidanylidene-thiomorpholine-3-carboxamide

Systemtic Name: N-(2,5-dimethoxyphenyl)-6-[(4-fluorophenyl)methyl]-5-oxidanylidene-thiomorpholine-3-carboxamide Openeye Name: N-(2,5-dimethoxyphenyl)-6-[(4-fluorophenyl)methyl]-5-oxo-thiomorpholine-3-carboxamide CAS Name: N-(2,5-dimethoxyphenyl)-6-[(4-fluorophenyl)methyl]-5-oxo-3-thiomorpholinecarboxamide IUPAC Name: N-(2,5-dimethoxyphenyl)-6-[(4-fluorophenyl)methyl]-5-oxothiomorpholine-3-carboxamide Traditional Name: N-(2,5-dimethoxyphenyl)-6-(4-fluorobenzyl)-5-keto-thiomorpholine-3-carboxamide Formula: C20H21FN2O4S MolecularWeight: 404.455143

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=O)C2CSC(C(=O)N2)CC3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=O)C2CSC(C(=O)N2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C20H21FN2O4S/c1-26-14-7-8-17(27-2)15(10-14)22-19(24)16-11-28-18(20(25)23-16)9-12-3-5-13(21)6-4-12/h3-8,10,16,18H,9,11H2,1-2H3,(H,22,24)(H,23,25)