7-phenoxathiin-2-yl-4-phenyl-2H-[1,2,4]triazino[3,4-a]phthalazine

Systemtic Name: 7-phenoxathiin-2-yl-4-phenyl-2H-[1,2,4]triazino[3,4-a]phthalazine Openeye Name: 7-phenoxathiin-2-yl-4-phenyl-2H-[1,2,4]triazino[3,4-a]phthalazine CAS Name: 7-(2-phenoxathiinyl)-4-phenyl-2H-[1,2,4]triazino[3,4-a]phthalazine IUPAC Name: 7-phenoxathiin-2-yl-4-phenyl-2H-[1,2,4]triazino[3,4-a]phthalazine Traditional Name: 7-phenoxathiin-2-yl-4-phenyl-2H-[1,2,4]triazino[3,4-a]phthalazine Formula: C28H18N4OS MolecularWeight: 458.53372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CNN=C3N2N=C(C4=CC=CC=C43)C5=CC6=C(C=C5)OC7=CC=CC=C7S6

Isomeric SMILES

C1=CC=C(C=C1)C2=CNN=C3N2N=C(C4=CC=CC=C43)C5=CC6=C(C=C5)OC7=CC=CC=C7S6

InChI

InChI=1S/C28H18N4OS/c1-2-8-18(9-3-1)22-17-29-30-28-21-11-5-4-10-20(21)27(31-32(22)28)19-14-15-24-26(16-19)34-25-13-7-6-12-23(25)33-24/h1-17,29H