2-(3-fluorophenyl)-N-[(3-morpholin-4-ylsulfonylphenyl)methyl]pyrimidine-5-carboxamide

Systemtic Name: 2-(3-fluorophenyl)-N-[(3-morpholin-4-ylsulfonylphenyl)methyl]pyrimidine-5-carboxamide Openeye Name: 2-(3-fluorophenyl)-N-[(3-morpholinosulfonylphenyl)methyl]pyrimidine-5-carboxamide CAS Name: 2-(3-fluorophenyl)-N-[[3-(4-morpholinylsulfonyl)phenyl]methyl]-5-pyrimidinecarboxamide IUPAC Name: 2-(3-fluorophenyl)-N-[(3-morpholin-4-ylsulfonylphenyl)methyl]pyrimidine-5-carboxamide Traditional Name: 2-(3-fluorophenyl)-N-(3-morpholinosulfonylbenzyl)pyrimidine-5-carboxamide Formula: C22H21FN4O4S MolecularWeight: 456.489943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)CNC(=O)C3=CN=C(N=C3)C4=CC(=CC=C4)F

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)CNC(=O)C3=CN=C(N=C3)C4=CC(=CC=C4)F

InChI

InChI=1S/C22H21FN4O4S/c23-19-5-2-4-17(12-19)21-24-14-18(15-25-21)22(28)26-13-16-3-1-6-20(11-16)32(29,30)27-7-9-31-10-8-27/h1-6,11-12,14-15H,7-10,13H2,(H,26,28)