3-phenyl-6-(phenylmethylsulfanyl)-[1,2,4]triazolo[3,4-a]phthalazine

Systemtic Name: 3-phenyl-6-(phenylmethylsulfanyl)-[1,2,4]triazolo[3,4-a]phthalazine Openeye Name: 6-benzylsulfanyl-3-phenyl-[1,2,4]triazolo[3,4-a]phthalazine CAS Name: 3-phenyl-6-(phenylmethylthio)-[1,2,4]triazolo[3,4-a]phthalazine IUPAC Name: 6-benzylsulfanyl-3-phenyl-[1,2,4]triazolo[3,4-a]phthalazine Traditional Name: 6-(benzylthio)-3-phenyl-[1,2,4]triazolo[3,4-a]phthalazine Formula: C22H16N4S MolecularWeight: 368.45424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NN3C(=NN=C3C4=CC=CC=C42)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NN3C(=NN=C3C4=CC=CC=C42)C5=CC=CC=C5

InChI

InChI=1S/C22H16N4S/c1-3-9-16(10-4-1)15-27-22-19-14-8-7-13-18(19)21-24-23-20(26(21)25-22)17-11-5-2-6-12-17/h1-14H,15H2