1-(phenylmethyl)-4-(phenylmethylsulfanyl)phthalazine

Systemtic Name: 1-(phenylmethyl)-4-(phenylmethylsulfanyl)phthalazine Openeye Name: 1-benzyl-4-benzylsulfanyl-phthalazine CAS Name: 1-(phenylmethyl)-4-(phenylmethylthio)phthalazine IUPAC Name: 1-benzyl-4-benzylsulfanylphthalazine Traditional Name: 1-benzyl-4-(benzylthio)phthalazine Formula: C22H18N2S MolecularWeight: 342.45672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NN=C(C3=CC=CC=C32)SCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC2=NN=C(C3=CC=CC=C32)SCC4=CC=CC=C4

InChI

InChI=1S/C22H18N2S/c1-3-9-17(10-4-1)15-21-19-13-7-8-14-20(19)22(24-23-21)25-16-18-11-5-2-6-12-18/h1-14H,15-16H2