N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]-1,3-benzothiazole-2-carboxamide

Systemtic Name: N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]-1,3-benzothiazole-2-carboxamide Openeye Name: N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]-1,3-benzothiazole-2-carboxamide CAS Name: N-[3-[6-(1-pyrrolidinyl)-3-pyridazinyl]phenyl]-1,3-benzothiazole-2-carboxamide IUPAC Name: N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]-1,3-benzothiazole-2-carboxamide Traditional Name: N-[3-(6-pyrrolidinopyridazin-3-yl)phenyl]-1,3-benzothiazole-2-carboxamide Formula: C22H19N5OS MolecularWeight: 401.48416

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CCN(C1)C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H19N5OS/c28-21(22-24-18-8-1-2-9-19(18)29-22)23-16-7-5-6-15(14-16)17-10-11-20(26-25-17)27-12-3-4-13-27/h1-2,5-11,14H,3-4,12-13H2,(H,23,28)