10-oxidanylidene-N-pyridin-3-yl-9-(sulfanylmethyl)azecane-2-carboxamide chloride

Systemtic Name: 10-oxidanylidene-N-pyridin-3-yl-9-(sulfanylmethyl)azecane-2-carboxamide chloride Openeye Name: 10-oxo-N-(3-pyridyl)-9-(sulfanylmethyl)azecane-2-carboxamide chloride CAS Name: 9-(mercaptomethyl)-10-oxo-N-(3-pyridinyl)-2-azecanecarboxamide chloride IUPAC Name: 10-oxo-N-pyridin-3-yl-9-(sulfanylmethyl)azecane-2-carboxamide chloride Traditional Name: 10-keto-9-(mercaptomethyl)-N-(3-pyridyl)azecane-2-carboxamide chloride Formula: C16H23ClN3O2S- MolecularWeight: 356.89072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(NC(=O)C(CC1)CS)C(=O)NC2=CN=CC=C2.[Cl-]

Isomeric SMILES

C1CCCC(NC(=O)C(CC1)CS)C(=O)NC2=CN=CC=C2.[Cl-]

InChI

InChI=1S/C16H23N3O2S.ClH/c20-15-12(11-22)6-3-1-2-4-8-14(19-15)16(21)18-13-7-5-9-17-10-13;/h5,7,9-10,12,14,22H,1-4,6,8,11H2,(H,18,21)(H,19,20);1H/p-1