2-[1-oxidanylidene-4-(pyridin-4-ylmethyl)phthalazin-2-yl]-N-[3-[(phenylmethyl)-propan-2-yl-amino]propyl]ethanamide

Systemtic Name: 2-[1-oxidanylidene-4-(pyridin-4-ylmethyl)phthalazin-2-yl]-N-[3-[(phenylmethyl)-propan-2-yl-amino]propyl]ethanamide Openeye Name: N-[3-[benzyl(isopropyl)amino]propyl]-2-[1-oxo-4-(4-pyridylmethyl)phthalazin-2-yl]acetamide CAS Name: 2-[1-oxo-4-(pyridin-4-ylmethyl)-2-phthalazinyl]-N-[3-[(phenylmethyl)-propan-2-ylamino]propyl]acetamide IUPAC Name: N-[3-[benzyl(propan-2-yl)amino]propyl]-2-[1-oxo-4-(pyridin-4-ylmethyl)phthalazin-2-yl]acetamide Traditional Name: N-[3-[benzyl(isopropyl)amino]propyl]-2-[1-keto-4-(4-pyridylmethyl)phthalazin-2-yl]acetamide Formula: C29H33N5O2 MolecularWeight: 483.60462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCCNC(=O)CN1C(=O)C2=CC=CC=C2C(=N1)CC3=CC=NC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)N(CCCNC(=O)CN1C(=O)C2=CC=CC=C2C(=N1)CC3=CC=NC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C29H33N5O2/c1-22(2)33(20-24-9-4-3-5-10-24)18-8-15-31-28(35)21-34-29(36)26-12-7-6-11-25(26)27(32-34)19-23-13-16-30-17-14-23/h3-7,9-14,16-17,22H,8,15,18-21H2,1-2H3,(H,31,35)