1-[(3-methoxyphenyl)methylsulfanyl]-4-phenyl-phthalazine

Systemtic Name: 1-[(3-methoxyphenyl)methylsulfanyl]-4-phenyl-phthalazine Openeye Name: 1-[(3-methoxyphenyl)methylsulfanyl]-4-phenyl-phthalazine CAS Name: 1-[(3-methoxyphenyl)methylthio]-4-phenylphthalazine IUPAC Name: 1-[(3-methoxyphenyl)methylsulfanyl]-4-phenylphthalazine Traditional Name: 1-(m-anisylthio)-4-phenyl-phthalazine Formula: C22H18N2OS MolecularWeight: 358.45612

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C22H18N2OS/c1-25-18-11-7-8-16(14-18)15-26-22-20-13-6-5-12-19(20)21(23-24-22)17-9-3-2-4-10-17/h2-14H,15H2,1H3