6-phenyl-3-(phenylmethylsulfanyl)-[1,2,4]triazolo[4,3-b]pyridazine

Systemtic Name: 6-phenyl-3-(phenylmethylsulfanyl)-[1,2,4]triazolo[4,3-b]pyridazine Openeye Name: 3-benzylsulfanyl-6-phenyl-[1,2,4]triazolo[4,3-b]pyridazine CAS Name: 6-phenyl-3-(phenylmethylthio)-[1,2,4]triazolo[4,3-b]pyridazine IUPAC Name: 3-benzylsulfanyl-6-phenyl-[1,2,4]triazolo[4,3-b]pyridazine Traditional Name: 3-(benzylthio)-6-phenyl-[1,2,4]triazolo[4,3-b]pyridazine Formula: C18H14N4S MolecularWeight: 318.39556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NN=C3N2N=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NN=C3N2N=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C18H14N4S/c1-3-7-14(8-4-1)13-23-18-20-19-17-12-11-16(21-22(17)18)15-9-5-2-6-10-15/h1-12H,13H2