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

Systemtic Name: N-butyl-3-[(6-phenylpyridazin-3-yl)sulfanylmethyl]benzamide Openeye Name: N-butyl-3-[(6-phenylpyridazin-3-yl)sulfanylmethyl]benzamide CAS Name: N-butyl-3-[[(6-phenyl-3-pyridazinyl)thio]methyl]benzamide IUPAC Name: N-butyl-3-[(6-phenylpyridazin-3-yl)sulfanylmethyl]benzamide Traditional Name: N-butyl-3-[[(6-phenylpyridazin-3-yl)thio]methyl]benzamide Formula: C22H23N3OS MolecularWeight: 377.50252

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3OS/c1-2-3-14-23-22(26)19-11-7-8-17(15-19)16-27-21-13-12-20(24-25-21)18-9-5-4-6-10-18/h4-13,15H,2-3,14,16H2,1H3,(H,23,26)