2-(3-methylbutylsulfanyl)-6-phenyl-1,3-diazinan-4-one

Systemtic Name: 2-(3-methylbutylsulfanyl)-6-phenyl-1,3-diazinan-4-one Openeye Name: 2-isopentylsulfanyl-6-phenyl-hexahydropyrimidin-4-one CAS Name: 2-(3-methylbutylthio)-6-phenyl-1,3-diazinan-4-one IUPAC Name: 2-(3-methylbutylsulfanyl)-6-phenyl-1,3-diazinan-4-one Traditional Name: 2-(isoamylthio)-6-phenyl-hexahydropyrimidin-4-one Formula: C15H22N2OS MolecularWeight: 278.41298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1NC(CC(=O)N1)C2=CC=CC=C2

Isomeric SMILES

CC(C)CCSC1NC(CC(=O)N1)C2=CC=CC=C2

InChI

InChI=1S/C15H22N2OS/c1-11(2)8-9-19-15-16-13(10-14(18)17-15)12-6-4-3-5-7-12/h3-7,11,13,15-16H,8-10H2,1-2H3,(H,17,18)