(3S)-1-(4-chlorophenyl)sulfonyl-N-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-chlorophenyl)sulfonyl-N-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]piperidine-3-carboxamide Openeye Name: (3S)-1-(4-chlorophenyl)sulfonyl-N-[2-(2-furylmethylamino)-2-oxo-ethyl]piperidine-3-carboxamide CAS Name: (3S)-1-(4-chlorophenyl)sulfonyl-N-[2-(2-furanylmethylamino)-2-oxoethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4-chlorophenyl)sulfonyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]piperidine-3-carboxamide Traditional Name: (3S)-1-(4-chlorophenyl)sulfonyl-N-[2-(2-furfurylamino)-2-keto-ethyl]nipecotamide Formula: C19H22ClN3O5S MolecularWeight: 439.91308

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)Cl)C(=O)NCC(=O)NCC3=CC=CO3

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=C(C=C2)Cl)C(=O)NCC(=O)NCC3=CC=CO3

InChI

InChI=1S/C19H22ClN3O5S/c20-15-5-7-17(8-6-15)29(26,27)23-9-1-3-14(13-23)19(25)22-12-18(24)21-11-16-4-2-10-28-16/h2,4-8,10,14H,1,3,9,11-13H2,(H,21,24)(H,22,25)/t14-/m0/s1