5-[(2-chlorophenyl)methyl]-6-methyl-2-pentylsulfanyl-1,3-diazinan-4-one

Systemtic Name: 5-[(2-chlorophenyl)methyl]-6-methyl-2-pentylsulfanyl-1,3-diazinan-4-one Openeye Name: 5-[(2-chlorophenyl)methyl]-6-methyl-2-pentylsulfanyl-hexahydropyrimidin-4-one CAS Name: 5-[(2-chlorophenyl)methyl]-6-methyl-2-(pentylthio)-1,3-diazinan-4-one IUPAC Name: 5-[(2-chlorophenyl)methyl]-6-methyl-2-pentylsulfanyl-1,3-diazinan-4-one Traditional Name: 2-(amylthio)-5-(2-chlorobenzyl)-6-methyl-hexahydropyrimidin-4-one Formula: C17H25ClN2OS MolecularWeight: 340.9112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1NC(C(C(=O)N1)CC2=CC=CC=C2Cl)C

Isomeric SMILES

CCCCCSC1NC(C(C(=O)N1)CC2=CC=CC=C2Cl)C

InChI

InChI=1S/C17H25ClN2OS/c1-3-4-7-10-22-17-19-12(2)14(16(21)20-17)11-13-8-5-6-9-15(13)18/h5-6,8-9,12,14,17,19H,3-4,7,10-11H2,1-2H3,(H,20,21)