2-(4-fluorophenyl)-N-(oxolan-2-ylmethyl)-4-thiomorpholin-4-yl-pyrimidine-5-carboxamide

Systemtic Name: 2-(4-fluorophenyl)-N-(oxolan-2-ylmethyl)-4-thiomorpholin-4-yl-pyrimidine-5-carboxamide Openeye Name: 2-(4-fluorophenyl)-N-(tetrahydrofuran-2-ylmethyl)-4-thiomorpholino-pyrimidine-5-carboxamide CAS Name: 2-(4-fluorophenyl)-N-(2-oxolanylmethyl)-4-thiomorpholin-4-yl-5-pyrimidinecarboxamide IUPAC Name: 2-(4-fluorophenyl)-N-(oxolan-2-ylmethyl)-4-thiomorpholin-4-ylpyrimidine-5-carboxamide Traditional Name: 2-(4-fluorophenyl)-N-(tetrahydrofurfuryl)-4-thiomorpholino-pyrimidine-5-carboxamide Formula: C20H23FN4O2S MolecularWeight: 402.485623

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)C2=CN=C(N=C2N3CCSCC3)C4=CC=C(C=C4)F

Isomeric SMILES

C1CC(OC1)CNC(=O)C2=CN=C(N=C2N3CCSCC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H23FN4O2S/c21-15-5-3-14(4-6-15)18-22-13-17(19(24-18)25-7-10-28-11-8-25)20(26)23-12-16-2-1-9-27-16/h3-6,13,16H,1-2,7-12H2,(H,23,26)