N-[4-(3-cyanopyridin-2-yl)oxy-2-methyl-phenyl]-1-ethylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[4-(3-cyanopyridin-2-yl)oxy-2-methyl-phenyl]-1-ethylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[4-[(3-cyano-2-pyridyl)oxy]-2-methyl-phenyl]-1-ethylsulfonyl-piperidine-4-carboxamide CAS Name: N-[4-[(3-cyano-2-pyridinyl)oxy]-2-methylphenyl]-1-ethylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[4-(3-cyanopyridin-2-yl)oxy-2-methylphenyl]-1-ethylsulfonylpiperidine-4-carboxamide Traditional Name: N-[4-[(3-cyano-2-pyridyl)oxy]-2-methyl-phenyl]-1-esyl-isonipecotamide Formula: C21H24N4O4S MolecularWeight: 428.50466

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)C(=O)NC2=C(C=C(C=C2)OC3=C(C=CC=N3)C#N)C

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)C(=O)NC2=C(C=C(C=C2)OC3=C(C=CC=N3)C#N)C

InChI

InChI=1S/C21H24N4O4S/c1-3-30(27,28)25-11-8-16(9-12-25)20(26)24-19-7-6-18(13-15(19)2)29-21-17(14-22)5-4-10-23-21/h4-7,10,13,16H,3,8-9,11-12H2,1-2H3,(H,24,26)