1-(2-pyrido[3,4-d]pyridazin-5-ylsulfanylphenyl)ethanone

Systemtic Name: 1-(2-pyrido[3,4-d]pyridazin-5-ylsulfanylphenyl)ethanone Openeye Name: 1-(2-pyrido[3,4-d]pyridazin-5-ylsulfanylphenyl)ethanone CAS Name: 1-[2-(5-pyrido[3,4-d]pyridazinylthio)phenyl]ethanone IUPAC Name: 1-(2-pyrido[3,4-d]pyridazin-5-ylsulfanylphenyl)ethanone Traditional Name: 1-[2-(pyrido[3,4-d]pyridazin-5-ylthio)phenyl]ethanone Formula: C15H11N3OS MolecularWeight: 281.33234

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1SC2=NC=CC3=CN=NC=C32

Isomeric SMILES

CC(=O)C1=CC=CC=C1SC2=NC=CC3=CN=NC=C32

InChI

InChI=1S/C15H11N3OS/c1-10(19)12-4-2-3-5-14(12)20-15-13-9-18-17-8-11(13)6-7-16-15/h2-9H,1H3