(3S)-1-(4-fluorophenyl)sulfonyl-N-[(2S)-5-methylhexan-2-yl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[(2S)-5-methylhexan-2-yl]piperidine-3-carboxamide Openeye Name: (3S)-N-[(1S)-1,4-dimethylpentyl]-1-(4-fluorophenyl)sulfonyl-piperidine-3-carboxamide CAS Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[(2S)-5-methylhexan-2-yl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[(2S)-5-methylhexan-2-yl]piperidine-3-carboxamide Traditional Name: (3S)-N-[(1S)-1,4-dimethylpentyl]-1-(4-fluorophenyl)sulfonyl-nipecotamide Formula: C19H29FN2O3S MolecularWeight: 384.508563

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H29FN2O3S/c1-14(2)6-7-15(3)21-19(23)16-5-4-12-22(13-16)26(24,25)18-10-8-17(20)9-11-18/h8-11,14-16H,4-7,12-13H2,1-3H3,(H,21,23)/t15-,16-/m0/s1