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

Systemtic Name: 5-[(2-chlorophenyl)methyl]-6-phenyl-2-prop-2-enylsulfanyl-1,3-diazinan-4-one Openeye Name: 2-allylsulfanyl-5-[(2-chlorophenyl)methyl]-6-phenyl-hexahydropyrimidin-4-one CAS Name: 5-[(2-chlorophenyl)methyl]-6-phenyl-2-(prop-2-enylthio)-1,3-diazinan-4-one IUPAC Name: 5-[(2-chlorophenyl)methyl]-6-phenyl-2-prop-2-enylsulfanyl-1,3-diazinan-4-one Traditional Name: 2-(allylthio)-5-(2-chlorobenzyl)-6-phenyl-hexahydropyrimidin-4-one Formula: C20H21ClN2OS MolecularWeight: 372.91154

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1NC(C(C(=O)N1)CC2=CC=CC=C2Cl)C3=CC=CC=C3

Isomeric SMILES

C=CCSC1NC(C(C(=O)N1)CC2=CC=CC=C2Cl)C3=CC=CC=C3

InChI

InChI=1S/C20H21ClN2OS/c1-2-12-25-20-22-18(14-8-4-3-5-9-14)16(19(24)23-20)13-15-10-6-7-11-17(15)21/h2-11,16,18,20,22H,1,12-13H2,(H,23,24)