3-[(2,4-dimethylphenyl)methyl]-6-methyl-2-(naphthalen-1-ylmethylsulfanyl)-5-(phenylmethyl)-1,3-diazinan-4-one

Systemtic Name: 3-[(2,4-dimethylphenyl)methyl]-6-methyl-2-(naphthalen-1-ylmethylsulfanyl)-5-(phenylmethyl)-1,3-diazinan-4-one Openeye Name: 5-benzyl-3-[(2,4-dimethylphenyl)methyl]-6-methyl-2-(1-naphthylmethylsulfanyl)hexahydropyrimidin-4-one CAS Name: 3-[(2,4-dimethylphenyl)methyl]-6-methyl-2-(1-naphthalenylmethylthio)-5-(phenylmethyl)-1,3-diazinan-4-one IUPAC Name: 5-benzyl-3-[(2,4-dimethylphenyl)methyl]-6-methyl-2-(naphthalen-1-ylmethylsulfanyl)-1,3-diazinan-4-one Traditional Name: 5-benzyl-3-(2,4-dimethylbenzyl)-6-methyl-2-(1-naphthylmethylthio)hexahydropyrimidin-4-one Formula: C32H34N2OS MolecularWeight: 494.69016

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=O)N(C(N1)SCC2=CC=CC3=CC=CC=C32)CC4=C(C=C(C=C4)C)C)CC5=CC=CC=C5

Isomeric SMILES

CC1C(C(=O)N(C(N1)SCC2=CC=CC3=CC=CC=C32)CC4=C(C=C(C=C4)C)C)CC5=CC=CC=C5

InChI

InChI=1S/C32H34N2OS/c1-22-16-17-27(23(2)18-22)20-34-31(35)30(19-25-10-5-4-6-11-25)24(3)33-32(34)36-21-28-14-9-13-26-12-7-8-15-29(26)28/h4-18,24,30,32-33H,19-21H2,1-3H3