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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NN(C2=O)CSC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=NN(C2=O)CSC3=CC=C(C=C3)Cl

InChI

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