6-(azepan-1-yl)-3-methyl-[1,2,4]triazolo[3,4-a]phthalazine

Systemtic Name: 6-(azepan-1-yl)-3-methyl-[1,2,4]triazolo[3,4-a]phthalazine Openeye Name: 6-(azepan-1-yl)-3-methyl-[1,2,4]triazolo[3,4-a]phthalazine CAS Name: 6-(1-azepanyl)-3-methyl-[1,2,4]triazolo[3,4-a]phthalazine IUPAC Name: 6-(azepan-1-yl)-3-methyl-[1,2,4]triazolo[3,4-a]phthalazine Traditional Name: 6-(azepan-1-yl)-3-methyl-[1,2,4]triazolo[3,4-a]phthalazine Formula: C16H19N5 MolecularWeight: 281.35556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C2N1N=C(C3=CC=CC=C32)N4CCCCCC4

Isomeric SMILES

CC1=NN=C2N1N=C(C3=CC=CC=C32)N4CCCCCC4

InChI

InChI=1S/C16H19N5/c1-12-17-18-15-13-8-4-5-9-14(13)16(19-21(12)15)20-10-6-2-3-7-11-20/h4-5,8-9H,2-3,6-7,10-11H2,1H3