2-(phenylmethylsulfanyl)-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]ethanamide

Systemtic Name: 2-(phenylmethylsulfanyl)-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]ethanamide Openeye Name: 2-benzylsulfanyl-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]acetamide CAS Name: 2-(phenylmethylthio)-N-[3-[6-(1-pyrrolidinyl)-3-pyridazinyl]phenyl]acetamide IUPAC Name: 2-benzylsulfanyl-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]acetamide Traditional Name: 2-(benzylthio)-N-[3-(6-pyrrolidinopyridazin-3-yl)phenyl]acetamide Formula: C23H24N4OS MolecularWeight: 404.52786

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)CSCC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)CSCC4=CC=CC=C4

InChI

InChI=1S/C23H24N4OS/c28-23(17-29-16-18-7-2-1-3-8-18)24-20-10-6-9-19(15-20)21-11-12-22(26-25-21)27-13-4-5-14-27/h1-3,6-12,15H,4-5,13-14,16-17H2,(H,24,28)