ethyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-[2-oxidanylidene-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]azanium

Systemtic Name: ethyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-[2-oxidanylidene-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]azanium Openeye Name: ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]ammonium CAS Name: ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]ammonium IUPAC Name: ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]azanium Traditional Name: ethyl-[(4-keto-1H-quinazolin-2-yl)methyl]-[2-keto-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]ammonium Formula: C21H26N5O4S+ MolecularWeight: 444.52724

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=NC(=O)C2=CC=CC=C2N1)CC(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC[NH+](CC1=NC(=O)C2=CC=CC=C2N1)CC(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C21H25N5O4S/c1-2-26(13-19-24-18-6-4-3-5-17(18)21(28)25-19)14-20(27)23-12-11-15-7-9-16(10-8-15)31(22,29)30/h3-10H,2,11-14H2,1H3,(H,23,27)(H2,22,29,30)(H,24,25,28)/p+1