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

Systemtic Name: 2-methyl-5-(3-propan-2-yl-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)-N-propyl-benzenesulfonamide Openeye Name: 5-(3-isopropyl-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)-2-methyl-N-propyl-benzenesulfonamide CAS Name: 2-methyl-5-(3-propan-2-yl-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)-N-propylbenzenesulfonamide IUPAC Name: 2-methyl-5-(3-propan-2-yl-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)-N-propylbenzenesulfonamide Traditional Name: 5-(3-isopropyl-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)-2-methyl-N-propyl-benzenesulfonamide Formula: C22H25N5O2S MolecularWeight: 423.5312

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Descriptors Computed from Structure

Canonical SMILES:

CCCNS(=O)(=O)C1=C(C=CC(=C1)C2=NN3C(=NN=C3C(C)C)C4=CC=CC=C42)C

Isomeric SMILES

CCCNS(=O)(=O)C1=C(C=CC(=C1)C2=NN3C(=NN=C3C(C)C)C4=CC=CC=C42)C

InChI

InChI=1S/C22H25N5O2S/c1-5-12-23-30(28,29)19-13-16(11-10-15(19)4)20-17-8-6-7-9-18(17)22-25-24-21(14(2)3)27(22)26-20/h6-11,13-14,23H,5,12H2,1-4H3