5-[5-azanyl-3-(3,4-dichlorophenyl)pentyl]-3-methylsulfanyl-1H-pyrazolo[4,3-c]pyridazin-6-one

Systemtic Name: 5-[5-azanyl-3-(3,4-dichlorophenyl)pentyl]-3-methylsulfanyl-1H-pyrazolo[4,3-c]pyridazin-6-one Openeye Name: 5-[5-amino-3-(3,4-dichlorophenyl)pentyl]-3-methylsulfanyl-1H-pyrazolo[4,3-c]pyridazin-6-one CAS Name: 5-[5-amino-3-(3,4-dichlorophenyl)pentyl]-3-(methylthio)-1H-pyrazolo[4,3-c]pyridazin-6-one IUPAC Name: 5-[5-amino-3-(3,4-dichlorophenyl)pentyl]-3-methylsulfanyl-1H-pyrazolo[4,3-c]pyridazin-6-one Traditional Name: 5-[5-amino-3-(3,4-dichlorophenyl)pentyl]-3-(methylthio)-1H-pyrazolo[4,3-c]pyridazin-6-one Formula: C17H19Cl2N5OS MolecularWeight: 412.33666

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NNC2=CC(=O)N(N=C21)CCC(CCN)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CSC1=NNC2=CC(=O)N(N=C21)CCC(CCN)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H19Cl2N5OS/c1-26-17-16-14(21-22-17)9-15(25)24(23-16)7-5-10(4-6-20)11-2-3-12(18)13(19)8-11/h2-3,8-10,21H,4-7,20H2,1H3