4-[3-(4-methoxyphenyl)sulfanyl-6-oxidanylidene-pyridazin-1-yl]-N-(3-phenylpropyl)benzamide

Systemtic Name: 4-[3-(4-methoxyphenyl)sulfanyl-6-oxidanylidene-pyridazin-1-yl]-N-(3-phenylpropyl)benzamide Openeye Name: 4-[3-(4-methoxyphenyl)sulfanyl-6-oxo-pyridazin-1-yl]-N-(3-phenylpropyl)benzamide CAS Name: 4-[3-[(4-methoxyphenyl)thio]-6-oxo-1-pyridazinyl]-N-(3-phenylpropyl)benzamide IUPAC Name: 4-[3-(4-methoxyphenyl)sulfanyl-6-oxopyridazin-1-yl]-N-(3-phenylpropyl)benzamide Traditional Name: 4-[6-keto-3-[(4-methoxyphenyl)thio]pyridazin-1-yl]-N-(3-phenylpropyl)benzamide Formula: C27H25N3O3S MolecularWeight: 471.5707

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SC2=NN(C(=O)C=C2)C3=CC=C(C=C3)C(=O)NCCCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)SC2=NN(C(=O)C=C2)C3=CC=C(C=C3)C(=O)NCCCC4=CC=CC=C4

InChI

InChI=1S/C27H25N3O3S/c1-33-23-13-15-24(16-14-23)34-25-17-18-26(31)30(29-25)22-11-9-21(10-12-22)27(32)28-19-5-8-20-6-3-2-4-7-20/h2-4,6-7,9-18H,5,8,19H2,1H3,(H,28,32)