2-[3-(tert-butylamino)-2-oxidanyl-propoxy]-4-(6-diazanylpyridazin-3-yl)benzenecarbonitrile

Systemtic Name: 2-[3-(tert-butylamino)-2-oxidanyl-propoxy]-4-(6-diazanylpyridazin-3-yl)benzenecarbonitrile Openeye Name: 2-[3-(tert-butylamino)-2-hydroxy-propoxy]-4-(6-hydrazinopyridazin-3-yl)benzonitrile CAS Name: 2-[3-(tert-butylamino)-2-hydroxypropoxy]-4-(6-hydrazinyl-3-pyridazinyl)benzonitrile IUPAC Name: 2-[3-(tert-butylamino)-2-hydroxypropoxy]-4-(6-hydrazinylpyridazin-3-yl)benzonitrile Traditional Name: 2-[3-(tert-butylamino)-2-hydroxy-propoxy]-4-(6-hydrazinopyridazin-3-yl)benzonitrile Formula: C18H24N6O2 MolecularWeight: 356.42216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC1=C(C=CC(=C1)C2=NN=C(C=C2)NN)C#N)O

Isomeric SMILES

CC(C)(C)NCC(COC1=C(C=CC(=C1)C2=NN=C(C=C2)NN)C#N)O

InChI

InChI=1S/C18H24N6O2/c1-18(2,3)21-10-14(25)11-26-16-8-12(4-5-13(16)9-19)15-6-7-17(22-20)24-23-15/h4-8,14,21,25H,10-11,20H2,1-3H3,(H,22,24)