N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-methyl-N-[[2-(1-pyrrolidinyl)phenyl]methyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-methyl-N-(2-pyrrolidinobenzyl)-1-(2-thienylsulfonyl)isonipecotamide Formula: C22H29N3O3S2 MolecularWeight: 447.61396

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1N2CCCC2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CN(CC1=CC=CC=C1N2CCCC2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C22H29N3O3S2/c1-23(17-19-7-2-3-8-20(19)24-12-4-5-13-24)22(26)18-10-14-25(15-11-18)30(27,28)21-9-6-16-29-21/h2-3,6-9,16,18H,4-5,10-15,17H2,1H3