4-[3-(4-chlorophenyl)sulfanyl-6-oxidanylidene-pyridazin-1-yl]-N-cyclooctyl-benzamide

Systemtic Name: 4-[3-(4-chlorophenyl)sulfanyl-6-oxidanylidene-pyridazin-1-yl]-N-cyclooctyl-benzamide Openeye Name: 4-[3-(4-chlorophenyl)sulfanyl-6-oxo-pyridazin-1-yl]-N-cyclooctyl-benzamide CAS Name: 4-[3-[(4-chlorophenyl)thio]-6-oxo-1-pyridazinyl]-N-cyclooctylbenzamide IUPAC Name: 4-[3-(4-chlorophenyl)sulfanyl-6-oxopyridazin-1-yl]-N-cyclooctylbenzamide Traditional Name: 4-[3-[(4-chlorophenyl)thio]-6-keto-pyridazin-1-yl]-N-cyclooctyl-benzamide Formula: C25H26ClN3O2S MolecularWeight: 468.01084

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)C2=CC=C(C=C2)N3C(=O)C=CC(=N3)SC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCCC(CCC1)NC(=O)C2=CC=C(C=C2)N3C(=O)C=CC(=N3)SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H26ClN3O2S/c26-19-10-14-22(15-11-19)32-23-16-17-24(30)29(28-23)21-12-8-18(9-13-21)25(31)27-20-6-4-2-1-3-5-7-20/h8-17,20H,1-7H2,(H,27,31)