4-[3-(4-fluorophenyl)sulfanyl-6-oxidanylidene-pyridazin-1-yl]-N-[(4-propan-2-yloxyphenyl)methyl]benzamide

Systemtic Name: 4-[3-(4-fluorophenyl)sulfanyl-6-oxidanylidene-pyridazin-1-yl]-N-[(4-propan-2-yloxyphenyl)methyl]benzamide Openeye Name: 4-[3-(4-fluorophenyl)sulfanyl-6-oxo-pyridazin-1-yl]-N-[(4-isopropoxyphenyl)methyl]benzamide CAS Name: 4-[3-[(4-fluorophenyl)thio]-6-oxo-1-pyridazinyl]-N-[(4-propan-2-yloxyphenyl)methyl]benzamide IUPAC Name: 4-[3-(4-fluorophenyl)sulfanyl-6-oxopyridazin-1-yl]-N-[(4-propan-2-yloxyphenyl)methyl]benzamide Traditional Name: 4-[3-[(4-fluorophenyl)thio]-6-keto-pyridazin-1-yl]-N-(4-isopropoxybenzyl)benzamide Formula: C27H24FN3O3S MolecularWeight: 489.561163

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)N3C(=O)C=CC(=N3)SC4=CC=C(C=C4)F

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)N3C(=O)C=CC(=N3)SC4=CC=C(C=C4)F

InChI

InChI=1S/C27H24FN3O3S/c1-18(2)34-23-11-3-19(4-12-23)17-29-27(33)20-5-9-22(10-6-20)31-26(32)16-15-25(30-31)35-24-13-7-21(28)8-14-24/h3-16,18H,17H2,1-2H3,(H,29,33)