4-[(4-chlorophenyl)sulfanylmethyl]-2H-phthalazin-1-one

Systemtic Name: 4-[(4-chlorophenyl)sulfanylmethyl]-2H-phthalazin-1-one Openeye Name: 4-[(4-chlorophenyl)sulfanylmethyl]-2H-phthalazin-1-one CAS Name: 4-[[(4-chlorophenyl)thio]methyl]-2H-phthalazin-1-one IUPAC Name: 4-[(4-chlorophenyl)sulfanylmethyl]-2H-phthalazin-1-one Traditional Name: 4-[[(4-chlorophenyl)thio]methyl]-2H-phthalazin-1-one Formula: C15H11ClN2OS MolecularWeight: 302.77864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)CSC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)CSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H11ClN2OS/c16-10-5-7-11(8-6-10)20-9-14-12-3-1-2-4-13(12)15(19)18-17-14/h1-8H,9H2,(H,18,19)