2-methyl-5-(3-pyridin-4-yl-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzenesulfonamide

Systemtic Name: 2-methyl-5-(3-pyridin-4-yl-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzenesulfonamide Openeye Name: 2-methyl-5-[3-(4-pyridyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-yl]benzenesulfonamide CAS Name: 2-methyl-5-(3-pyridin-4-yl-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzenesulfonamide IUPAC Name: 2-methyl-5-(3-pyridin-4-yl-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzenesulfonamide Traditional Name: 2-methyl-5-[3-(4-pyridyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-yl]benzenesulfonamide Formula: C21H16N6O2S MolecularWeight: 416.45574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN3C(=NN=C3C4=CC=CC=C42)C5=CC=NC=C5)S(=O)(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN3C(=NN=C3C4=CC=CC=C42)C5=CC=NC=C5)S(=O)(=O)N

InChI

InChI=1S/C21H16N6O2S/c1-13-6-7-15(12-18(13)30(22,28)29)19-16-4-2-3-5-17(16)21-25-24-20(27(21)26-19)14-8-10-23-11-9-14/h2-12H,1H3,(H2,22,28,29)