3-(2-bromophenyl)-6-pyrrolidin-1-yl-[1,2,4]triazolo[3,4-a]phthalazine

Systemtic Name: 3-(2-bromophenyl)-6-pyrrolidin-1-yl-[1,2,4]triazolo[3,4-a]phthalazine Openeye Name: 3-(2-bromophenyl)-6-pyrrolidin-1-yl-[1,2,4]triazolo[3,4-a]phthalazine CAS Name: 3-(2-bromophenyl)-6-(1-pyrrolidinyl)-[1,2,4]triazolo[3,4-a]phthalazine IUPAC Name: 3-(2-bromophenyl)-6-pyrrolidin-1-yl-[1,2,4]triazolo[3,4-a]phthalazine Traditional Name: 3-(2-bromophenyl)-6-pyrrolidino-[1,2,4]triazolo[3,4-a]phthalazine Formula: C19H16BrN5 MolecularWeight: 394.26784

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NN3C(=NN=C3C4=CC=CC=C4Br)C5=CC=CC=C52

Isomeric SMILES

C1CCN(C1)C2=NN3C(=NN=C3C4=CC=CC=C4Br)C5=CC=CC=C52

InChI

InChI=1S/C19H16BrN5/c20-16-10-4-3-9-15(16)18-22-21-17-13-7-1-2-8-14(13)19(23-25(17)18)24-11-5-6-12-24/h1-4,7-10H,5-6,11-12H2