2-[[3-[5-[3-(dimethylamino)propoxy]pyrimidin-2-yl]phenyl]methyl]-6-phenylazanyl-pyridazin-3-one

Systemtic Name: 2-[[3-[5-[3-(dimethylamino)propoxy]pyrimidin-2-yl]phenyl]methyl]-6-phenylazanyl-pyridazin-3-one Openeye Name: 6-anilino-2-[[3-[5-[3-(dimethylamino)propoxy]pyrimidin-2-yl]phenyl]methyl]pyridazin-3-one CAS Name: 6-anilino-2-[[3-[5-[3-(dimethylamino)propoxy]-2-pyrimidinyl]phenyl]methyl]-3-pyridazinone IUPAC Name: 6-anilino-2-[[3-[5-[3-(dimethylamino)propoxy]pyrimidin-2-yl]phenyl]methyl]pyridazin-3-one Traditional Name: 6-anilino-2-[3-[5-[3-(dimethylamino)propoxy]pyrimidin-2-yl]benzyl]pyridazin-3-one Formula: C26H28N6O2 MolecularWeight: 456.53952

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCOC1=CN=C(N=C1)C2=CC(=CC=C2)CN3C(=O)C=CC(=N3)NC4=CC=CC=C4

Isomeric SMILES

CN(C)CCCOC1=CN=C(N=C1)C2=CC(=CC=C2)CN3C(=O)C=CC(=N3)NC4=CC=CC=C4

InChI

InChI=1S/C26H28N6O2/c1-31(2)14-7-15-34-23-17-27-26(28-18-23)21-9-6-8-20(16-21)19-32-25(33)13-12-24(30-32)29-22-10-4-3-5-11-22/h3-6,8-13,16-18H,7,14-15,19H2,1-2H3,(H,29,30)