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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)CC2=CC(=C(C=C2)Cl)Cl)C(=O)NCC3=CN=CC=C3

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)CC2=CC(=C(C=C2)Cl)Cl)C(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C19H21Cl2N3O3S/c20-17-6-5-14(9-18(17)21)13-28(26,27)24-8-2-4-16(12-24)19(25)23-11-15-3-1-7-22-10-15/h1,3,5-7,9-10,16H,2,4,8,11-13H2,(H,23,25)/t16-/m0/s1