(3S)-1-(4-bromophenyl)sulfonyl-N-pentan-3-yl-piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-bromophenyl)sulfonyl-N-pentan-3-yl-piperidine-3-carboxamide Openeye Name: (3S)-1-(4-bromophenyl)sulfonyl-N-(1-ethylpropyl)piperidine-3-carboxamide CAS Name: (3S)-1-(4-bromophenyl)sulfonyl-N-pentan-3-yl-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4-bromophenyl)sulfonyl-N-pentan-3-ylpiperidine-3-carboxamide Traditional Name: (3S)-1-brosyl-N-(1-ethylpropyl)nipecotamide Formula: C17H25BrN2O3S MolecularWeight: 417.361

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCC(CC)NC(=O)[C@H]1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C17H25BrN2O3S/c1-3-15(4-2)19-17(21)13-6-5-11-20(12-13)24(22,23)16-9-7-14(18)8-10-16/h7-10,13,15H,3-6,11-12H2,1-2H3,(H,19,21)/t13-/m0/s1