N-hexyl-3-[(6-phenylpyridazin-3-yl)sulfanylmethyl]benzamide

Systemtic Name: N-hexyl-3-[(6-phenylpyridazin-3-yl)sulfanylmethyl]benzamide Openeye Name: N-hexyl-3-[(6-phenylpyridazin-3-yl)sulfanylmethyl]benzamide CAS Name: N-hexyl-3-[[(6-phenyl-3-pyridazinyl)thio]methyl]benzamide IUPAC Name: N-hexyl-3-[(6-phenylpyridazin-3-yl)sulfanylmethyl]benzamide Traditional Name: N-hexyl-3-[[(6-phenylpyridazin-3-yl)thio]methyl]benzamide Formula: C24H27N3OS MolecularWeight: 405.55568

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1=CC(=CC=C1)CSC2=NN=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCCCNC(=O)C1=CC(=CC=C1)CSC2=NN=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C24H27N3OS/c1-2-3-4-8-16-25-24(28)21-13-9-10-19(17-21)18-29-23-15-14-22(26-27-23)20-11-6-5-7-12-20/h5-7,9-15,17H,2-4,8,16,18H2,1H3,(H,25,28)