N3-[4-(pyridin-4-ylmethyl)phthalazin-1-yl]benzene-1,3-diamine

Systemtic Name: N3-[4-(pyridin-4-ylmethyl)phthalazin-1-yl]benzene-1,3-diamine Openeye Name: N3-[4-(4-pyridylmethyl)phthalazin-1-yl]benzene-1,3-diamine CAS Name: N3-[4-(pyridin-4-ylmethyl)-1-phthalazinyl]benzene-1,3-diamine IUPAC Name: 3-N-[4-(pyridin-4-ylmethyl)phthalazin-1-yl]benzene-1,3-diamine Traditional Name: (3-aminophenyl)-[4-(4-pyridylmethyl)phthalazin-1-yl]amine Formula: C20H17N5 MolecularWeight: 327.38248

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN=C2NC3=CC=CC(=C3)N)CC4=CC=NC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN=C2NC3=CC=CC(=C3)N)CC4=CC=NC=C4

InChI

InChI=1S/C20H17N5/c21-15-4-3-5-16(13-15)23-20-18-7-2-1-6-17(18)19(24-25-20)12-14-8-10-22-11-9-14/h1-11,13H,12,21H2,(H,23,25)