N-[[2-(diethylaminomethyl)phenyl]methyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[[2-(diethylaminomethyl)phenyl]methyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[[2-(diethylaminomethyl)phenyl]methyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide CAS Name: N-[[2-(diethylaminomethyl)phenyl]methyl]-1-(4-methoxyphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: N-[[2-(diethylaminomethyl)phenyl]methyl]-1-(4-methoxyphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-[2-(diethylaminomethyl)benzyl]-1-(4-methoxyphenyl)sulfonyl-nipecotamide Formula: C25H35N3O4S MolecularWeight: 473.6281

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC=CC=C1CNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCN(CC)CC1=CC=CC=C1CNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C25H35N3O4S/c1-4-27(5-2)18-21-10-7-6-9-20(21)17-26-25(29)22-11-8-16-28(19-22)33(30,31)24-14-12-23(32-3)13-15-24/h6-7,9-10,12-15,22H,4-5,8,11,16-19H2,1-3H3,(H,26,29)