1-methylsulfonyl-N-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-methylsulfonyl-N-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]piperidine-4-carboxamide Openeye Name: 1-methylsulfonyl-N-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]piperidine-4-carboxamide CAS Name: 1-methylsulfonyl-N-[[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-methylsulfonyl-N-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]piperidine-4-carboxamide Traditional Name: 1-mesyl-N-(4-pyrrolidinosulfonylbenzyl)isonipecotamide Formula: C18H27N3O5S2 MolecularWeight: 429.55408

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C18H27N3O5S2/c1-27(23,24)20-12-8-16(9-13-20)18(22)19-14-15-4-6-17(7-5-15)28(25,26)21-10-2-3-11-21/h4-7,16H,2-3,8-14H2,1H3,(H,19,22)