2-(phenylmethylsulfanyl)-1H-azepine

Systemtic Name: 2-(phenylmethylsulfanyl)-1H-azepine Openeye Name: 2-benzylsulfanyl-1H-azepine CAS Name: 2-(phenylmethylthio)-1H-azepine IUPAC Name: 2-benzylsulfanyl-1H-azepine Traditional Name: 2-(benzylthio)-1H-azepine Formula: C13H13NS MolecularWeight: 215.31402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=CC=CC=CN2

Isomeric SMILES

C1=CC=C(C=C1)CSC2=CC=CC=CN2

InChI

InChI=1S/C13H13NS/c1-3-7-12(8-4-1)11-15-13-9-5-2-6-10-14-13/h1-10,14H,11H2