4-[[4-(1,3-benzodioxol-5-ylamino)thieno[2,3-d]pyridazin-7-yl]oxymethyl]-N-methyl-pyridine-2-carboxamide

Systemtic Name: 4-[[4-(1,3-benzodioxol-5-ylamino)thieno[2,3-d]pyridazin-7-yl]oxymethyl]-N-methyl-pyridine-2-carboxamide Openeye Name: 4-[[4-(1,3-benzodioxol-5-ylamino)thieno[2,3-d]pyridazin-7-yl]oxymethyl]-N-methyl-pyridine-2-carboxamide CAS Name: 4-[[4-(1,3-benzodioxol-5-ylamino)-7-thieno[2,3-d]pyridazinyl]oxymethyl]-N-methyl-2-pyridinecarboxamide IUPAC Name: 4-[[4-(1,3-benzodioxol-5-ylamino)thieno[2,3-d]pyridazin-7-yl]oxymethyl]-N-methylpyridine-2-carboxamide Traditional Name: 4-[[4-(1,3-benzodioxol-5-ylamino)thieno[2,3-d]pyridazin-7-yl]oxymethyl]-N-methyl-picolinamide Formula: C21H17N5O4S MolecularWeight: 435.45578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=NC=CC(=C1)COC2=NN=C(C3=C2SC=C3)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CNC(=O)C1=NC=CC(=C1)COC2=NN=C(C3=C2SC=C3)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H17N5O4S/c1-22-20(27)15-8-12(4-6-23-15)10-28-21-18-14(5-7-31-18)19(25-26-21)24-13-2-3-16-17(9-13)30-11-29-16/h2-9H,10-11H2,1H3,(H,22,27)(H,24,25)