N-ethyl-N-[(4-phenylmethoxyphenyl)methyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-ethyl-N-[(4-phenylmethoxyphenyl)methyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[(4-benzyloxyphenyl)methyl]-N-ethyl-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-ethyl-N-[(4-phenylmethoxyphenyl)methyl]-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-ethyl-N-[(4-phenylmethoxyphenyl)methyl]-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(4-benzoxybenzyl)-N-ethyl-1-(3-pyridylsulfonyl)isonipecotamide Formula: C27H31N3O4S MolecularWeight: 493.61774

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

CCN(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

InChI

InChI=1S/C27H31N3O4S/c1-2-29(20-22-10-12-25(13-11-22)34-21-23-7-4-3-5-8-23)27(31)24-14-17-30(18-15-24)35(32,33)26-9-6-16-28-19-26/h3-13,16,19,24H,2,14-15,17-18,20-21H2,1H3