N-[2-(6-oxidanylidene-3-pyridin-3-yl-pyridazin-1-yl)ethyl]-3-phenylsulfanyl-propanamide

Systemtic Name: N-[2-(6-oxidanylidene-3-pyridin-3-yl-pyridazin-1-yl)ethyl]-3-phenylsulfanyl-propanamide Openeye Name: N-[2-[6-oxo-3-(3-pyridyl)pyridazin-1-yl]ethyl]-3-phenylsulfanyl-propanamide CAS Name: N-[2-[6-oxo-3-(3-pyridinyl)-1-pyridazinyl]ethyl]-3-(phenylthio)propanamide IUPAC Name: N-[2-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)ethyl]-3-phenylsulfanylpropanamide Traditional Name: N-[2-[6-keto-3-(3-pyridyl)pyridazin-1-yl]ethyl]-3-(phenylthio)propionamide Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCC(=O)NCCN2C(=O)C=CC(=N2)C3=CN=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)SCCC(=O)NCCN2C(=O)C=CC(=N2)C3=CN=CC=C3

InChI

InChI=1S/C20H20N4O2S/c25-19(10-14-27-17-6-2-1-3-7-17)22-12-13-24-20(26)9-8-18(23-24)16-5-4-11-21-15-16/h1-9,11,15H,10,12-14H2,(H,22,25)