2-chloranyl-5-methylsulfanyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]benzamide

Systemtic Name: 2-chloranyl-5-methylsulfanyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]benzamide Openeye Name: 2-chloro-5-methylsulfanyl-N-[3-(2-oxoazepan-1-yl)propyl]benzamide CAS Name: 2-chloro-5-(methylthio)-N-[3-(2-oxo-1-azepanyl)propyl]benzamide IUPAC Name: 2-chloro-5-methylsulfanyl-N-[3-(2-oxoazepan-1-yl)propyl]benzamide Traditional Name: 2-chloro-N-[3-(2-ketoazepan-1-yl)propyl]-5-(methylthio)benzamide Formula: C17H23ClN2O2S MolecularWeight: 354.89472

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(C=C1)Cl)C(=O)NCCCN2CCCCCC2=O

Isomeric SMILES

CSC1=CC(=C(C=C1)Cl)C(=O)NCCCN2CCCCCC2=O

InChI

InChI=1S/C17H23ClN2O2S/c1-23-13-7-8-15(18)14(12-13)17(22)19-9-5-11-20-10-4-2-3-6-16(20)21/h7-8,12H,2-6,9-11H2,1H3,(H,19,22)