N-[(5-bromanyl-2-methoxy-phenyl)methyl]-N-methyl-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(5-bromanyl-2-methoxy-phenyl)methyl]-N-methyl-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[(5-bromo-2-methoxy-phenyl)methyl]-N-methyl-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-[(5-bromo-2-methoxyphenyl)methyl]-N-methyl-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[(5-bromo-2-methoxyphenyl)methyl]-N-methyl-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(5-bromo-2-methoxy-benzyl)-N-methyl-1-(3-pyridylsulfonyl)isonipecotamide Formula: C20H24BrN3O4S MolecularWeight: 482.39126

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)Br)OC)C(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

CN(CC1=C(C=CC(=C1)Br)OC)C(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C20H24BrN3O4S/c1-23(14-16-12-17(21)5-6-19(16)28-2)20(25)15-7-10-24(11-8-15)29(26,27)18-4-3-9-22-13-18/h3-6,9,12-13,15H,7-8,10-11,14H2,1-2H3