N-[2-(4-fluoranylphenoxy)-5-morpholin-4-ylsulfonyl-phenyl]-5-methyl-pyrazine-2-carboxamide

Systemtic Name: N-[2-(4-fluoranylphenoxy)-5-morpholin-4-ylsulfonyl-phenyl]-5-methyl-pyrazine-2-carboxamide Openeye Name: N-[2-(4-fluorophenoxy)-5-morpholinosulfonyl-phenyl]-5-methyl-pyrazine-2-carboxamide CAS Name: N-[2-(4-fluorophenoxy)-5-(4-morpholinylsulfonyl)phenyl]-5-methyl-2-pyrazinecarboxamide IUPAC Name: N-[2-(4-fluorophenoxy)-5-morpholin-4-ylsulfonylphenyl]-5-methylpyrazine-2-carboxamide Traditional Name: N-[2-(4-fluorophenoxy)-5-morpholinosulfonyl-phenyl]-5-methyl-pyrazinamide Formula: C22H21FN4O5S MolecularWeight: 472.489343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)OC4=CC=C(C=C4)F

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)OC4=CC=C(C=C4)F

InChI

InChI=1S/C22H21FN4O5S/c1-15-13-25-20(14-24-15)22(28)26-19-12-18(33(29,30)27-8-10-31-11-9-27)6-7-21(19)32-17-4-2-16(23)3-5-17/h2-7,12-14H,8-11H2,1H3,(H,26,28)