3-[[6-(4-fluorophenyl)pyridazin-3-yl]sulfanylmethyl]-N-(1-phenylethyl)benzamide

Systemtic Name: 3-[[6-(4-fluorophenyl)pyridazin-3-yl]sulfanylmethyl]-N-(1-phenylethyl)benzamide Openeye Name: 3-[[6-(4-fluorophenyl)pyridazin-3-yl]sulfanylmethyl]-N-(1-phenylethyl)benzamide CAS Name: 3-[[[6-(4-fluorophenyl)-3-pyridazinyl]thio]methyl]-N-(1-phenylethyl)benzamide IUPAC Name: 3-[[6-(4-fluorophenyl)pyridazin-3-yl]sulfanylmethyl]-N-(1-phenylethyl)benzamide Traditional Name: 3-[[[6-(4-fluorophenyl)pyridazin-3-yl]thio]methyl]-N-(1-phenylethyl)benzamide Formula: C26H22FN3OS MolecularWeight: 443.535783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=CC(=CC=C2)CSC3=NN=C(C=C3)C4=CC=C(C=C4)F

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C2=CC(=CC=C2)CSC3=NN=C(C=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C26H22FN3OS/c1-18(20-7-3-2-4-8-20)28-26(31)22-9-5-6-19(16-22)17-32-25-15-14-24(29-30-25)21-10-12-23(27)13-11-21/h2-16,18H,17H2,1H3,(H,28,31)