7-phenoxathiin-2-yl-2,4-dihydro-[1,2,4]triazino[3,4-a]phthalazin-3-one

Systemtic Name: 7-phenoxathiin-2-yl-2,4-dihydro-[1,2,4]triazino[3,4-a]phthalazin-3-one Openeye Name: 7-phenoxathiin-2-yl-2,4-dihydro-[1,2,4]triazino[3,4-a]phthalazin-3-one CAS Name: 7-(2-phenoxathiinyl)-2,4-dihydro-[1,2,4]triazino[3,4-a]phthalazin-3-one IUPAC Name: 7-phenoxathiin-2-yl-2,4-dihydro-[1,2,4]triazino[3,4-a]phthalazin-3-one Traditional Name: 7-phenoxathiin-2-yl-2,4-dihydro-[1,2,4]triazino[3,4-a]phthalazin-3-one Formula: C22H14N4O2S MolecularWeight: 398.43716

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NN=C2N1N=C(C3=CC=CC=C32)C4=CC5=C(C=C4)OC6=CC=CC=C6S5

Isomeric SMILES

C1C(=O)NN=C2N1N=C(C3=CC=CC=C32)C4=CC5=C(C=C4)OC6=CC=CC=C6S5

InChI

InChI=1S/C22H14N4O2S/c27-20-12-26-22(24-23-20)15-6-2-1-5-14(15)21(25-26)13-9-10-17-19(11-13)29-18-8-4-3-7-16(18)28-17/h1-11H,12H2,(H,23,27)