3-[6-(1,3-benzothiazol-6-ylamino)pyridazin-3-yl]-N-(3-methylsulfanylphenyl)benzamide

Systemtic Name: 3-[6-(1,3-benzothiazol-6-ylamino)pyridazin-3-yl]-N-(3-methylsulfanylphenyl)benzamide Openeye Name: 3-[6-(1,3-benzothiazol-6-ylamino)pyridazin-3-yl]-N-(3-methylsulfanylphenyl)benzamide CAS Name: 3-[6-(1,3-benzothiazol-6-ylamino)-3-pyridazinyl]-N-[3-(methylthio)phenyl]benzamide IUPAC Name: 3-[6-(1,3-benzothiazol-6-ylamino)pyridazin-3-yl]-N-(3-methylsulfanylphenyl)benzamide Traditional Name: 3-[6-(1,3-benzothiazol-6-ylamino)pyridazin-3-yl]-N-[3-(methylthio)phenyl]benzamide Formula: C25H19N5OS2 MolecularWeight: 469.58126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)C2=CC=CC(=C2)C3=NN=C(C=C3)NC4=CC5=C(C=C4)N=CS5

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)C2=CC=CC(=C2)C3=NN=C(C=C3)NC4=CC5=C(C=C4)N=CS5

InChI

InChI=1S/C25H19N5OS2/c1-32-20-7-3-6-18(13-20)28-25(31)17-5-2-4-16(12-17)21-10-11-24(30-29-21)27-19-8-9-22-23(14-19)33-15-26-22/h2-15H,1H3,(H,27,30)(H,28,31)