4-propyl-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]-1,2,3-thiadiazole-5-carboxamide

Systemtic Name: 4-propyl-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]-1,2,3-thiadiazole-5-carboxamide Openeye Name: 4-propyl-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]thiadiazole-5-carboxamide CAS Name: 4-propyl-N-[3-[6-(1-pyrrolidinyl)-3-pyridazinyl]phenyl]-5-thiadiazolecarboxamide IUPAC Name: 4-propyl-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]thiadiazole-5-carboxamide Traditional Name: 4-propyl-N-[3-(6-pyrrolidinopyridazin-3-yl)phenyl]thiadiazole-5-carboxamide Formula: C20H22N6OS MolecularWeight: 394.49328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(SN=N1)C(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)N4CCCC4

Isomeric SMILES

CCCC1=C(SN=N1)C(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)N4CCCC4

InChI

InChI=1S/C20H22N6OS/c1-2-6-17-19(28-25-23-17)20(27)21-15-8-5-7-14(13-15)16-9-10-18(24-22-16)26-11-3-4-12-26/h5,7-10,13H,2-4,6,11-12H2,1H3,(H,21,27)