N-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]-3-pyrimidin-2-yl-propanamide

Systemtic Name: N-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]-3-pyrimidin-2-yl-propanamide Openeye Name: N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-3-pyrimidin-2-yl-propanamide CAS Name: N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-3-(2-pyrimidinyl)propanamide IUPAC Name: N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-3-pyrimidin-2-ylpropanamide Traditional Name: N-[3-[(4-keto-3H-phthalazin-1-yl)amino]propyl]-3-(2-pyrimidyl)propionamide Formula: C18H20N6O2 MolecularWeight: 352.3904

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NN=C2NCCCNC(=O)CCC3=NC=CC=N3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NN=C2NCCCNC(=O)CCC3=NC=CC=N3

InChI

InChI=1S/C18H20N6O2/c25-16(8-7-15-19-9-3-10-20-15)21-11-4-12-22-17-13-5-1-2-6-14(13)18(26)24-23-17/h1-3,5-6,9-10H,4,7-8,11-12H2,(H,21,25)(H,22,23)(H,24,26)