N-[6-(3,4-dimethylphenoxy)pyridin-3-yl]-1-methylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[6-(3,4-dimethylphenoxy)pyridin-3-yl]-1-methylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[6-(3,4-dimethylphenoxy)-3-pyridyl]-1-methylsulfonyl-piperidine-3-carboxamide CAS Name: N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-1-methylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[6-(3,4-dimethylphenoxy)pyridin-3-yl]-1-methylsulfonylpiperidine-3-carboxamide Traditional Name: N-[6-(3,4-dimethylphenoxy)-3-pyridyl]-1-mesyl-nipecotamide Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC2=NC=C(C=C2)NC(=O)C3CCCN(C3)S(=O)(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC2=NC=C(C=C2)NC(=O)C3CCCN(C3)S(=O)(=O)C)C

InChI

InChI=1S/C20H25N3O4S/c1-14-6-8-18(11-15(14)2)27-19-9-7-17(12-21-19)22-20(24)16-5-4-10-23(13-16)28(3,25)26/h6-9,11-12,16H,4-5,10,13H2,1-3H3,(H,22,24)