2-azanyl-3-(4-chlorophenyl)sulfonyl-1-(3-morpholin-4-ium-4-ylpropyl)-6H-pyrrolo[2,3-d]pyridazin-7-one

Systemtic Name: 2-azanyl-3-(4-chlorophenyl)sulfonyl-1-(3-morpholin-4-ium-4-ylpropyl)-6H-pyrrolo[2,3-d]pyridazin-7-one Openeye Name: 2-amino-3-(4-chlorophenyl)sulfonyl-1-(3-morpholin-4-ium-4-ylpropyl)-6H-pyrrolo[2,3-d]pyridazin-7-one CAS Name: 2-amino-3-(4-chlorophenyl)sulfonyl-1-[3-(4-morpholin-4-iumyl)propyl]-6H-pyrrolo[2,3-d]pyridazin-7-one IUPAC Name: 2-amino-3-(4-chlorophenyl)sulfonyl-1-(3-morpholin-4-ium-4-ylpropyl)-6H-pyrrolo[2,3-d]pyridazin-7-one Traditional Name: 2-amino-3-(4-chlorophenyl)sulfonyl-1-(3-morpholin-4-ium-4-ylpropyl)-6H-pyrrolo[2,3-d]pyridazin-7-one Formula: C19H23ClN5O4S+ MolecularWeight: 452.93502

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCN2C3=C(C=NNC3=O)C(=C2N)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1COCC[NH+]1CCCN2C3=C(C=NNC3=O)C(=C2N)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C19H22ClN5O4S/c20-13-2-4-14(5-3-13)30(27,28)17-15-12-22-23-19(26)16(15)25(18(17)21)7-1-6-24-8-10-29-11-9-24/h2-5,12H,1,6-11,21H2,(H,23,26)/p+1