phenyl-[3-(phenylmethylsulfanyl)-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-6-yl]methanone

Systemtic Name: phenyl-[3-(phenylmethylsulfanyl)-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-6-yl]methanone Openeye Name: (3-benzylsulfanyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-6-yl)-phenyl-methanone CAS Name: phenyl-[3-(phenylmethylthio)-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-6-yl]methanone IUPAC Name: (3-benzylsulfanyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-6-yl)-phenylmethanone Traditional Name: [3-(benzylthio)-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-6-yl]-phenyl-methanone Formula: C21H19N3OS MolecularWeight: 361.46006

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC(=NN=C21)SCC3=CC=CC=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC2=CC(=NN=C21)SCC3=CC=CC=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H19N3OS/c25-21(17-9-5-2-6-10-17)24-12-11-19-18(14-24)13-20(23-22-19)26-15-16-7-3-1-4-8-16/h1-10,13H,11-12,14-15H2