N-[4-[3-(tert-butylamino)-2-oxidanyl-propoxy]-3-(6-diazanylpyridazin-3-yl)phenyl]ethanamide

Systemtic Name: N-[4-[3-(tert-butylamino)-2-oxidanyl-propoxy]-3-(6-diazanylpyridazin-3-yl)phenyl]ethanamide Openeye Name: N-[4-[3-(tert-butylamino)-2-hydroxy-propoxy]-3-(6-hydrazinopyridazin-3-yl)phenyl]acetamide CAS Name: N-[4-[3-(tert-butylamino)-2-hydroxypropoxy]-3-(6-hydrazinyl-3-pyridazinyl)phenyl]acetamide IUPAC Name: N-[4-[3-(tert-butylamino)-2-hydroxypropoxy]-3-(6-hydrazinylpyridazin-3-yl)phenyl]acetamide Traditional Name: N-[4-[3-(tert-butylamino)-2-hydroxy-propoxy]-3-(6-hydrazinopyridazin-3-yl)phenyl]acetamide Formula: C19H28N6O3 MolecularWeight: 388.46402

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)OCC(CNC(C)(C)C)O)C2=NN=C(C=C2)NN

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)OCC(CNC(C)(C)C)O)C2=NN=C(C=C2)NN

InChI

InChI=1S/C19H28N6O3/c1-12(26)22-13-5-7-17(28-11-14(27)10-21-19(2,3)4)15(9-13)16-6-8-18(23-20)25-24-16/h5-9,14,21,27H,10-11,20H2,1-4H3,(H,22,26)(H,23,25)