3-[[6-(4-methylphenyl)pyridazin-3-yl]sulfanylmethyl]-N-propyl-benzamide

Systemtic Name: 3-[[6-(4-methylphenyl)pyridazin-3-yl]sulfanylmethyl]-N-propyl-benzamide Openeye Name: N-propyl-3-[[6-(p-tolyl)pyridazin-3-yl]sulfanylmethyl]benzamide CAS Name: 3-[[[6-(4-methylphenyl)-3-pyridazinyl]thio]methyl]-N-propylbenzamide IUPAC Name: 3-[[6-(4-methylphenyl)pyridazin-3-yl]sulfanylmethyl]-N-propylbenzamide Traditional Name: N-propyl-3-[[[6-(p-tolyl)pyridazin-3-yl]thio]methyl]benzamide Formula: C22H23N3OS MolecularWeight: 377.50252

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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