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

Systemtic Name: 2-[1-oxidanylidene-4-(pyridin-3-ylmethyl)phthalazin-2-yl]-N-(3-propan-2-yloxypropyl)ethanamide Openeye Name: N-(3-isopropoxypropyl)-2-[1-oxo-4-(3-pyridylmethyl)phthalazin-2-yl]acetamide CAS Name: 2-[1-oxo-4-(3-pyridinylmethyl)-2-phthalazinyl]-N-(3-propan-2-yloxypropyl)acetamide IUPAC Name: 2-[1-oxo-4-(pyridin-3-ylmethyl)phthalazin-2-yl]-N-(3-propan-2-yloxypropyl)acetamide Traditional Name: N-(3-isopropoxypropyl)-2-[1-keto-4-(3-pyridylmethyl)phthalazin-2-yl]acetamide Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC(=O)CN1C(=O)C2=CC=CC=C2C(=N1)CC3=CN=CC=C3

Isomeric SMILES

CC(C)OCCCNC(=O)CN1C(=O)C2=CC=CC=C2C(=N1)CC3=CN=CC=C3

InChI

InChI=1S/C22H26N4O3/c1-16(2)29-12-6-11-24-21(27)15-26-22(28)19-9-4-3-8-18(19)20(25-26)13-17-7-5-10-23-14-17/h3-5,7-10,14,16H,6,11-13,15H2,1-2H3,(H,24,27)