1-(1,3-benzodioxol-5-ylmethylsulfanyl)-4-phenyl-phthalazine

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethylsulfanyl)-4-phenyl-phthalazine Openeye Name: 1-(1,3-benzodioxol-5-ylmethylsulfanyl)-4-phenyl-phthalazine CAS Name: 1-(1,3-benzodioxol-5-ylmethylthio)-4-phenylphthalazine IUPAC Name: 1-(1,3-benzodioxol-5-ylmethylsulfanyl)-4-phenylphthalazine Traditional Name: 1-phenyl-4-(piperonylthio)phthalazine Formula: C22H16N2O2S MolecularWeight: 372.43964

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CSC3=NN=C(C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CSC3=NN=C(C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C22H16N2O2S/c1-2-6-16(7-3-1)21-17-8-4-5-9-18(17)22(24-23-21)27-13-15-10-11-19-20(12-15)26-14-25-19/h1-12H,13-14H2