azepan-1-yl-(2-methoxy-4-methylsulfanyl-phenyl)methanone

Systemtic Name: azepan-1-yl-(2-methoxy-4-methylsulfanyl-phenyl)methanone Openeye Name: azepan-1-yl-(2-methoxy-4-methylsulfanyl-phenyl)methanone CAS Name: 1-azepanyl-[2-methoxy-4-(methylthio)phenyl]methanone IUPAC Name: azepan-1-yl-(2-methoxy-4-methylsulfanylphenyl)methanone Traditional Name: azepan-1-yl-[2-methoxy-4-(methylthio)phenyl]methanone Formula: C15H21NO2S MolecularWeight: 279.39774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)SC)C(=O)N2CCCCCC2

Isomeric SMILES

COC1=C(C=CC(=C1)SC)C(=O)N2CCCCCC2

InChI

InChI=1S/C15H21NO2S/c1-18-14-11-12(19-2)7-8-13(14)15(17)16-9-5-3-4-6-10-16/h7-8,11H,3-6,9-10H2,1-2H3