2-[(9-azanyl-5-methyl-acridin-4-yl)carbonylamino]ethyl-ethyl-[(3-nitrothiophen-2-yl)methyl]azanium chloride

Systemtic Name: 2-[(9-azanyl-5-methyl-acridin-4-yl)carbonylamino]ethyl-ethyl-[(3-nitrothiophen-2-yl)methyl]azanium chloride Openeye Name: 2-[(9-amino-5-methyl-acridine-4-carbonyl)amino]ethyl-ethyl-[(3-nitro-2-thienyl)methyl]ammonium chloride CAS Name: 2-[[(9-amino-5-methyl-4-acridinyl)-oxomethyl]amino]ethyl-ethyl-[(3-nitro-2-thiophenyl)methyl]ammonium chloride IUPAC Name: 2-[(9-amino-5-methylacridine-4-carbonyl)amino]ethyl-ethyl-[(3-nitrothiophen-2-yl)methyl]azanium chloride Traditional Name: 2-[(9-amino-5-methyl-acridine-4-carbonyl)amino]ethyl-ethyl-[(3-nitro-2-thienyl)methyl]ammonium chloride Formula: C24H26ClN5O3S MolecularWeight: 500.01294

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCNC(=O)C1=CC=CC2=C1N=C3C(=CC=CC3=C2N)C)CC4=C(C=CS4)[N+](=O)[O-].[Cl-]

Isomeric SMILES

CC[NH+](CCNC(=O)C1=CC=CC2=C1N=C3C(=CC=CC3=C2N)C)CC4=C(C=CS4)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C24H25N5O3S.ClH/c1-3-28(14-20-19(29(31)32)10-13-33-20)12-11-26-24(30)18-9-5-8-17-21(25)16-7-4-6-15(2)22(16)27-23(17)18;/h4-10,13H,3,11-12,14H2,1-2H3,(H2,25,27)(H,26,30);1H