(4-aminocarbonylacridin-9-yl)-[4-(butylsulfonylamino)-2-methoxy-phenyl]azanium chloride

Systemtic Name: (4-aminocarbonylacridin-9-yl)-[4-(butylsulfonylamino)-2-methoxy-phenyl]azanium chloride Openeye Name: [4-(butylsulfonylamino)-2-methoxy-phenyl]-(4-carbamoylacridin-9-yl)ammonium chloride CAS Name: [4-(butylsulfonylamino)-2-methoxyphenyl]-(4-carbamoyl-9-acridinyl)ammonium chloride IUPAC Name: [4-(butylsulfonylamino)-2-methoxyphenyl]-(4-carbamoylacridin-9-yl)azanium chloride Traditional Name: [4-(butylsulfonylamino)-2-methoxy-phenyl]-(4-carbamoylacridin-9-yl)ammonium chloride Formula: C25H27ClN4O4S MolecularWeight: 515.02428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC1=CC(=C(C=C1)[NH2+]C2=C3C=CC=C(C3=NC4=CC=CC=C42)C(=O)N)OC.[Cl-]

Isomeric SMILES

CCCCS(=O)(=O)NC1=CC(=C(C=C1)[NH2+]C2=C3C=CC=C(C3=NC4=CC=CC=C42)C(=O)N)OC.[Cl-]

InChI

InChI=1S/C25H26N4O4S.ClH/c1-3-4-14-34(31,32)29-16-12-13-21(22(15-16)33-2)28-23-17-8-5-6-11-20(17)27-24-18(23)9-7-10-19(24)25(26)30;/h5-13,15,29H,3-4,14H2,1-2H3,(H2,26,30)(H,27,28);1H