3-[2-azanyl-3-(4-chlorophenyl)sulfonyl-7-oxidanylidene-6H-pyrrolo[2,3-d]pyridazin-1-yl]propyl-diethyl-azanium

Systemtic Name: 3-[2-azanyl-3-(4-chlorophenyl)sulfonyl-7-oxidanylidene-6H-pyrrolo[2,3-d]pyridazin-1-yl]propyl-diethyl-azanium Openeye Name: 3-[2-amino-3-(4-chlorophenyl)sulfonyl-7-oxo-6H-pyrrolo[2,3-d]pyridazin-1-yl]propyl-diethyl-ammonium CAS Name: 3-[2-amino-3-(4-chlorophenyl)sulfonyl-7-oxo-6H-pyrrolo[2,3-d]pyridazin-1-yl]propyl-diethylammonium IUPAC Name: 3-[2-amino-3-(4-chlorophenyl)sulfonyl-7-oxo-6H-pyrrolo[2,3-d]pyridazin-1-yl]propyl-diethylazanium Traditional Name: 3-[2-amino-3-(4-chlorophenyl)sulfonyl-7-keto-6H-pyrrolo[2,3-d]pyridazin-1-yl]propyl-diethyl-ammonium Formula: C19H25ClN5O3S+ MolecularWeight: 438.9515

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCN1C2=C(C=NNC2=O)C(=C1N)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC[NH+](CC)CCCN1C2=C(C=NNC2=O)C(=C1N)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H24ClN5O3S/c1-3-24(4-2)10-5-11-25-16-15(12-22-23-19(16)26)17(18(25)21)29(27,28)14-8-6-13(20)7-9-14/h6-9,12H,3-5,10-11,21H2,1-2H3,(H,23,26)/p+1