5-butyl-2-pentylsulfanyl-6-phenyl-1,3-diazinan-4-one

Systemtic Name: 5-butyl-2-pentylsulfanyl-6-phenyl-1,3-diazinan-4-one Openeye Name: 5-butyl-2-pentylsulfanyl-6-phenyl-hexahydropyrimidin-4-one CAS Name: 5-butyl-2-(pentylthio)-6-phenyl-1,3-diazinan-4-one IUPAC Name: 5-butyl-2-pentylsulfanyl-6-phenyl-1,3-diazinan-4-one Traditional Name: 2-(amylthio)-5-butyl-6-phenyl-hexahydropyrimidin-4-one Formula: C19H30N2OS MolecularWeight: 334.5193

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1NC(C(C(=O)N1)CCCC)C2=CC=CC=C2

Isomeric SMILES

CCCCCSC1NC(C(C(=O)N1)CCCC)C2=CC=CC=C2

InChI

InChI=1S/C19H30N2OS/c1-3-5-10-14-23-19-20-17(15-11-8-7-9-12-15)16(13-6-4-2)18(22)21-19/h7-9,11-12,16-17,19-20H,3-6,10,13-14H2,1-2H3,(H,21,22)