5-azanyl-6-morpholin-4-ylcarbonyl-2-phenyl-4-(thiolan-1-ium-1-yl)pyridazin-3-one

Systemtic Name: 5-azanyl-6-morpholin-4-ylcarbonyl-2-phenyl-4-(thiolan-1-ium-1-yl)pyridazin-3-one Openeye Name: 5-amino-6-(morpholine-4-carbonyl)-2-phenyl-4-tetrahydrothiophen-1-ium-1-yl-pyridazin-3-one CAS Name: 5-amino-6-[4-morpholinyl(oxo)methyl]-2-phenyl-4-(1-thiolan-1-iumyl)-3-pyridazinone IUPAC Name: 5-amino-6-(morpholine-4-carbonyl)-2-phenyl-4-(thiolan-1-ium-1-yl)pyridazin-3-one Traditional Name: 5-amino-6-(morpholine-4-carbonyl)-2-phenyl-4-tetrahydrothiophen-1-ium-1-yl-pyridazin-3-one Formula: C19H23N4O3S+ MolecularWeight: 387.47592

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[S+](C1)C2=C(C(=NN(C2=O)C3=CC=CC=C3)C(=O)N4CCOCC4)N

Isomeric SMILES

C1CC[S+](C1)C2=C(C(=NN(C2=O)C3=CC=CC=C3)C(=O)N4CCOCC4)N

InChI

InChI=1S/C19H22N4O3S/c20-15-16(18(24)22-8-10-26-11-9-22)21-23(14-6-2-1-3-7-14)19(25)17(15)27-12-4-5-13-27/h1-3,6-7H,4-5,8-13H2,(H-,20,25)/p+1