N-[6-[4-oxidanylidene-4-(pyridin-4-ylmethylamino)butyl]sulfanylpyridazin-3-yl]furan-2-carboxamide

Systemtic Name: N-[6-[4-oxidanylidene-4-(pyridin-4-ylmethylamino)butyl]sulfanylpyridazin-3-yl]furan-2-carboxamide Openeye Name: N-[6-[4-oxo-4-(4-pyridylmethylamino)butyl]sulfanylpyridazin-3-yl]furan-2-carboxamide CAS Name: N-[6-[[4-oxo-4-(pyridin-4-ylmethylamino)butyl]thio]-3-pyridazinyl]-2-furancarboxamide IUPAC Name: N-[6-[4-oxo-4-(pyridin-4-ylmethylamino)butyl]sulfanylpyridazin-3-yl]furan-2-carboxamide Traditional Name: N-[6-[[4-keto-4-(4-pyridylmethylamino)butyl]thio]pyridazin-3-yl]-2-furamide Formula: C19H19N5O3S MolecularWeight: 397.45086

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C(=O)NC2=NN=C(C=C2)SCCCC(=O)NCC3=CC=NC=C3

Isomeric SMILES

C1=COC(=C1)C(=O)NC2=NN=C(C=C2)SCCCC(=O)NCC3=CC=NC=C3

InChI

InChI=1S/C19H19N5O3S/c25-17(21-13-14-7-9-20-10-8-14)4-2-12-28-18-6-5-16(23-24-18)22-19(26)15-3-1-11-27-15/h1,3,5-11H,2,4,12-13H2,(H,21,25)(H,22,23,26)