5-(4-phenylmethoxybutyl)-1,3-diazinane-2-thione

Systemtic Name: 5-(4-phenylmethoxybutyl)-1,3-diazinane-2-thione Openeye Name: 5-(4-benzyloxybutyl)hexahydropyrimidine-2-thione CAS Name: 5-(4-phenylmethoxybutyl)-1,3-diazinane-2-thione IUPAC Name: 5-(4-phenylmethoxybutyl)-1,3-diazinane-2-thione Traditional Name: 5-(4-benzoxybutyl)hexahydropyrimidine-2-thione Formula: C15H22N2OS MolecularWeight: 278.41298

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CNC(=S)N1)CCCCOCC2=CC=CC=C2

Isomeric SMILES

C1C(CNC(=S)N1)CCCCOCC2=CC=CC=C2

InChI

InChI=1S/C15H22N2OS/c19-15-16-10-14(11-17-15)8-4-5-9-18-12-13-6-2-1-3-7-13/h1-3,6-7,14H,4-5,8-12H2,(H2,16,17,19)