1-phenyl-4-(phenylsulfanylmethyl)-1,2-diazinan-3-one

Systemtic Name: 1-phenyl-4-(phenylsulfanylmethyl)-1,2-diazinan-3-one Openeye Name: 1-phenyl-4-(phenylsulfanylmethyl)hexahydropyridazin-3-one CAS Name: 1-phenyl-4-[(phenylthio)methyl]-3-diazinanone IUPAC Name: 1-phenyl-4-(phenylsulfanylmethyl)diazinan-3-one Traditional Name: 1-phenyl-4-[(phenylthio)methyl]hexahydropyridazin-3-one Formula: C17H18N2OS MolecularWeight: 298.40262

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(NC(=O)C1CSC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C1CN(NC(=O)C1CSC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C17H18N2OS/c20-17-14(13-21-16-9-5-2-6-10-16)11-12-19(18-17)15-7-3-1-4-8-15/h1-10,14H,11-13H2,(H,18,20)