(3S)-1-[(2,4-dichlorophenyl)methylsulfonyl]-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide

Systemtic Name: (3S)-1-[(2,4-dichlorophenyl)methylsulfonyl]-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide Openeye Name: (3S)-1-[(2,4-dichlorophenyl)methylsulfonyl]-N-(2-pyridylmethyl)piperidine-3-carboxamide CAS Name: (3S)-1-[(2,4-dichlorophenyl)methylsulfonyl]-N-(2-pyridinylmethyl)-3-piperidinecarboxamide IUPAC Name: (3S)-1-[(2,4-dichlorophenyl)methylsulfonyl]-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide Traditional Name: (3S)-1-(2,4-dichlorobenzyl)sulfonyl-N-(2-pyridylmethyl)nipecotamide Formula: C19H21Cl2N3O3S MolecularWeight: 442.35934

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)CC2=C(C=C(C=C2)Cl)Cl)C(=O)NCC3=CC=CC=N3

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)CC2=C(C=C(C=C2)Cl)Cl)C(=O)NCC3=CC=CC=N3

InChI

InChI=1S/C19H21Cl2N3O3S/c20-16-7-6-15(18(21)10-16)13-28(26,27)24-9-3-4-14(12-24)19(25)23-11-17-5-1-2-8-22-17/h1-2,5-8,10,14H,3-4,9,11-13H2,(H,23,25)/t14-/m0/s1