3-[4-[3-(tert-butylamino)-2-oxidanyl-propoxy]-3-morpholin-4-yl-phenyl]-4,5-dihydro-1H-pyridazin-6-one

Systemtic Name: 3-[4-[3-(tert-butylamino)-2-oxidanyl-propoxy]-3-morpholin-4-yl-phenyl]-4,5-dihydro-1H-pyridazin-6-one Openeye Name: 3-[4-[3-(tert-butylamino)-2-hydroxy-propoxy]-3-morpholino-phenyl]-4,5-dihydro-1H-pyridazin-6-one CAS Name: 3-[4-[3-(tert-butylamino)-2-hydroxypropoxy]-3-(4-morpholinyl)phenyl]-4,5-dihydro-1H-pyridazin-6-one IUPAC Name: 3-[4-[3-(tert-butylamino)-2-hydroxypropoxy]-3-morpholin-4-ylphenyl]-4,5-dihydro-1H-pyridazin-6-one Traditional Name: 3-[4-[3-(tert-butylamino)-2-hydroxy-propoxy]-3-morpholino-phenyl]-4,5-dihydro-1H-pyridazin-6-one Formula: C21H32N4O4 MolecularWeight: 404.50318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC1=C(C=C(C=C1)C2=NNC(=O)CC2)N3CCOCC3)O

Isomeric SMILES

CC(C)(C)NCC(COC1=C(C=C(C=C1)C2=NNC(=O)CC2)N3CCOCC3)O

InChI

InChI=1S/C21H32N4O4/c1-21(2,3)22-13-16(26)14-29-19-6-4-15(17-5-7-20(27)24-23-17)12-18(19)25-8-10-28-11-9-25/h4,6,12,16,22,26H,5,7-11,13-14H2,1-3H3,(H,24,27)