N-[2-(4-chloranylphenoxy)-5-piperidin-1-ylsulfonyl-phenyl]pyrazine-2-carboxamide

Systemtic Name: N-[2-(4-chloranylphenoxy)-5-piperidin-1-ylsulfonyl-phenyl]pyrazine-2-carboxamide Openeye Name: N-[2-(4-chlorophenoxy)-5-(1-piperidylsulfonyl)phenyl]pyrazine-2-carboxamide CAS Name: N-[2-(4-chlorophenoxy)-5-(1-piperidinylsulfonyl)phenyl]-2-pyrazinecarboxamide IUPAC Name: N-[2-(4-chlorophenoxy)-5-piperidin-1-ylsulfonylphenyl]pyrazine-2-carboxamide Traditional Name: N-[2-(4-chlorophenoxy)-5-piperidinosulfonyl-phenyl]pyrazinamide Formula: C22H21ClN4O4S MolecularWeight: 472.94454

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC3=CC=C(C=C3)Cl)NC(=O)C4=NC=CN=C4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC3=CC=C(C=C3)Cl)NC(=O)C4=NC=CN=C4

InChI

InChI=1S/C22H21ClN4O4S/c23-16-4-6-17(7-5-16)31-21-9-8-18(32(29,30)27-12-2-1-3-13-27)14-19(21)26-22(28)20-15-24-10-11-25-20/h4-11,14-15H,1-3,12-13H2,(H,26,28)