5-(naphthalen-1-ylmethyl)-6-phenyl-2-(phenylmethylsulfanyl)-1,3-diazinan-4-one

Systemtic Name: 5-(naphthalen-1-ylmethyl)-6-phenyl-2-(phenylmethylsulfanyl)-1,3-diazinan-4-one Openeye Name: 2-benzylsulfanyl-5-(1-naphthylmethyl)-6-phenyl-hexahydropyrimidin-4-one CAS Name: 5-(1-naphthalenylmethyl)-6-phenyl-2-(phenylmethylthio)-1,3-diazinan-4-one IUPAC Name: 2-benzylsulfanyl-5-(naphthalen-1-ylmethyl)-6-phenyl-1,3-diazinan-4-one Traditional Name: 2-(benzylthio)-5-(1-naphthylmethyl)-6-phenyl-hexahydropyrimidin-4-one Formula: C28H26N2OS MolecularWeight: 438.58384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2NC(C(C(=O)N2)CC3=CC=CC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CSC2NC(C(C(=O)N2)CC3=CC=CC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C28H26N2OS/c31-27-25(18-23-16-9-15-21-12-7-8-17-24(21)23)26(22-13-5-2-6-14-22)29-28(30-27)32-19-20-10-3-1-4-11-20/h1-17,25-26,28-29H,18-19H2,(H,30,31)