azepan-1-yl-[2-(phenylmethylsulfanyl)phenyl]methanone

Systemtic Name: azepan-1-yl-[2-(phenylmethylsulfanyl)phenyl]methanone Openeye Name: azepan-1-yl-(2-benzylsulfanylphenyl)methanone CAS Name: 1-azepanyl-[2-(phenylmethylthio)phenyl]methanone IUPAC Name: azepan-1-yl-(2-benzylsulfanylphenyl)methanone Traditional Name: azepan-1-yl-[2-(benzylthio)phenyl]methanone Formula: C20H23NOS MolecularWeight: 325.46772

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC=CC=C2SCC3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC=CC=C2SCC3=CC=CC=C3

InChI

InChI=1S/C20H23NOS/c22-20(21-14-8-1-2-9-15-21)18-12-6-7-13-19(18)23-16-17-10-4-3-5-11-17/h3-7,10-13H,1-2,8-9,14-16H2