(3S)-N-butyl-1-[4-(2-methylpropylsulfamoyl)phenyl]sulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-butyl-1-[4-(2-methylpropylsulfamoyl)phenyl]sulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-butyl-1-[4-(isobutylsulfamoyl)phenyl]sulfonyl-piperidine-3-carboxamide CAS Name: (3S)-N-butyl-1-[4-(2-methylpropylsulfamoyl)phenyl]sulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-butyl-1-[4-(2-methylpropylsulfamoyl)phenyl]sulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-butyl-1-[4-(isobutylsulfamoyl)phenyl]sulfonyl-nipecotamide Formula: C20H33N3O5S2 MolecularWeight: 459.62312

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NCC(C)C

Isomeric SMILES

CCCCNC(=O)[C@H]1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NCC(C)C

InChI

InChI=1S/C20H33N3O5S2/c1-4-5-12-21-20(24)17-7-6-13-23(15-17)30(27,28)19-10-8-18(9-11-19)29(25,26)22-14-16(2)3/h8-11,16-17,22H,4-7,12-15H2,1-3H3,(H,21,24)/t17-/m0/s1