[3-[6-(4-chloranylphenoxy)hexyl]-4-oxidanylidene-1-pyridin-4-yl-1,3-diazinan-2-ylidene]cyanamide

Systemtic Name: [3-[6-(4-chloranylphenoxy)hexyl]-4-oxidanylidene-1-pyridin-4-yl-1,3-diazinan-2-ylidene]cyanamide Openeye Name: [3-[6-(4-chlorophenoxy)hexyl]-4-oxo-1-(4-pyridyl)hexahydropyrimidin-2-ylidene]cyanamide CAS Name: [3-[6-(4-chlorophenoxy)hexyl]-4-oxo-1-pyridin-4-yl-1,3-diazinan-2-ylidene]cyanamide IUPAC Name: [3-[6-(4-chlorophenoxy)hexyl]-4-oxo-1-pyridin-4-yl-1,3-diazinan-2-ylidene]cyanamide Traditional Name: [3-[6-(4-chlorophenoxy)hexyl]-4-keto-1-(4-pyridyl)hexahydropyrimidin-2-ylidene]cyanamide Formula: C22H24ClN5O2 MolecularWeight: 425.91126

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=NC#N)N(C1=O)CCCCCCOC2=CC=C(C=C2)Cl)C3=CC=NC=C3

Isomeric SMILES

C1CN(C(=NC#N)N(C1=O)CCCCCCOC2=CC=C(C=C2)Cl)C3=CC=NC=C3

InChI

InChI=1S/C22H24ClN5O2/c23-18-5-7-20(8-6-18)30-16-4-2-1-3-14-28-21(29)11-15-27(22(28)26-17-24)19-9-12-25-13-10-19/h5-10,12-13H,1-4,11,14-16H2