N-butan-2-yl-4-[[6-(4-methylphenyl)pyridazin-3-yl]sulfanylmethyl]benzamide

Systemtic Name: N-butan-2-yl-4-[[6-(4-methylphenyl)pyridazin-3-yl]sulfanylmethyl]benzamide Openeye Name: 4-[[6-(p-tolyl)pyridazin-3-yl]sulfanylmethyl]-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-4-[[[6-(4-methylphenyl)-3-pyridazinyl]thio]methyl]benzamide IUPAC Name: N-butan-2-yl-4-[[6-(4-methylphenyl)pyridazin-3-yl]sulfanylmethyl]benzamide Traditional Name: 4-[[[6-(p-tolyl)pyridazin-3-yl]thio]methyl]-N-sec-butyl-benzamide Formula: C23H25N3OS MolecularWeight: 391.5291

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC=C(C=C1)CSC2=NN=C(C=C2)C3=CC=C(C=C3)C

Isomeric SMILES

CCC(C)NC(=O)C1=CC=C(C=C1)CSC2=NN=C(C=C2)C3=CC=C(C=C3)C

InChI

InChI=1S/C23H25N3OS/c1-4-17(3)24-23(27)20-11-7-18(8-12-20)15-28-22-14-13-21(25-26-22)19-9-5-16(2)6-10-19/h5-14,17H,4,15H2,1-3H3,(H,24,27)