N-[(2-chlorophenyl)methyl]-2-oxidanylidene-6-(thiomorpholin-4-ium-4-ylmethyl)-1H-pyridine-3-carboxamide

Systemtic Name: N-[(2-chlorophenyl)methyl]-2-oxidanylidene-6-(thiomorpholin-4-ium-4-ylmethyl)-1H-pyridine-3-carboxamide Openeye Name: N-[(2-chlorophenyl)methyl]-2-oxo-6-(thiomorpholin-4-ium-4-ylmethyl)-1H-pyridine-3-carboxamide CAS Name: N-[(2-chlorophenyl)methyl]-2-oxo-6-(4-thiomorpholin-4-iumylmethyl)-1H-pyridine-3-carboxamide IUPAC Name: N-[(2-chlorophenyl)methyl]-2-oxo-6-(thiomorpholin-4-ium-4-ylmethyl)-1H-pyridine-3-carboxamide Traditional Name: N-(2-chlorobenzyl)-2-keto-6-(thiomorpholin-4-ium-4-ylmethyl)-1H-pyridine-3-carboxamide Formula: C18H21ClN3O2S+ MolecularWeight: 378.89624

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCC[NH+]1CC2=CC=C(C(=O)N2)C(=O)NCC3=CC=CC=C3Cl

Isomeric SMILES

C1CSCC[NH+]1CC2=CC=C(C(=O)N2)C(=O)NCC3=CC=CC=C3Cl

InChI

InChI=1S/C18H20ClN3O2S/c19-16-4-2-1-3-13(16)11-20-17(23)15-6-5-14(21-18(15)24)12-22-7-9-25-10-8-22/h1-6H,7-12H2,(H,20,23)(H,21,24)/p+1