N-[6-[4-(cyclopropylamino)-4-oxidanylidene-butyl]sulfanylpyridazin-3-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[6-[4-(cyclopropylamino)-4-oxidanylidene-butyl]sulfanylpyridazin-3-yl]-4-fluoranyl-benzamide Openeye Name: N-[6-[4-(cyclopropylamino)-4-oxo-butyl]sulfanylpyridazin-3-yl]-4-fluoro-benzamide CAS Name: N-[6-[[4-(cyclopropylamino)-4-oxobutyl]thio]-3-pyridazinyl]-4-fluorobenzamide IUPAC Name: N-[6-[4-(cyclopropylamino)-4-oxobutyl]sulfanylpyridazin-3-yl]-4-fluorobenzamide Traditional Name: N-[6-[[4-(cyclopropylamino)-4-keto-butyl]thio]pyridazin-3-yl]-4-fluoro-benzamide Formula: C18H19FN4O2S MolecularWeight: 374.432463

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CCCSC2=NN=C(C=C2)NC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CC1NC(=O)CCCSC2=NN=C(C=C2)NC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H19FN4O2S/c19-13-5-3-12(4-6-13)18(25)21-15-9-10-17(23-22-15)26-11-1-2-16(24)20-14-7-8-14/h3-6,9-10,14H,1-2,7-8,11H2,(H,20,24)(H,21,22,25)