2-(4-phenoxathiin-2-ylphthalazin-1-yl)-1,5-dihydropyrazol-3-amine

Systemtic Name: 2-(4-phenoxathiin-2-ylphthalazin-1-yl)-1,5-dihydropyrazol-3-amine Openeye Name: 2-(4-phenoxathiin-2-ylphthalazin-1-yl)-1,5-dihydropyrazol-3-amine CAS Name: 2-[4-(2-phenoxathiinyl)-1-phthalazinyl]-1,5-dihydropyrazol-3-amine IUPAC Name: 2-(4-phenoxathiin-2-ylphthalazin-1-yl)-1,5-dihydropyrazol-3-amine Traditional Name: [2-(4-phenoxathiin-2-ylphthalazin-1-yl)-3-pyrazolin-3-yl]amine Formula: C23H17N5OS MolecularWeight: 411.47898

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(N(N1)C2=NN=C(C3=CC=CC=C32)C4=CC5=C(C=C4)OC6=CC=CC=C6S5)N

Isomeric SMILES

C1C=C(N(N1)C2=NN=C(C3=CC=CC=C32)C4=CC5=C(C=C4)OC6=CC=CC=C6S5)N

InChI

InChI=1S/C23H17N5OS/c24-21-11-12-25-28(21)23-16-6-2-1-5-15(16)22(26-27-23)14-9-10-18-20(13-14)30-19-8-4-3-7-17(19)29-18/h1-11,13,25H,12,24H2