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

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

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

Isomeric SMILES

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

InChI

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