2-[(4-ethylsulfonylpiperazin-1-ium-1-yl)methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(4-ethylsulfonylpiperazin-1-ium-1-yl)methyl]-1H-quinazolin-4-one Openeye Name: 2-[(4-ethylsulfonylpiperazin-1-ium-1-yl)methyl]-1H-quinazolin-4-one CAS Name: 2-[(4-ethylsulfonyl-1-piperazin-1-iumyl)methyl]-1H-quinazolin-4-one IUPAC Name: 2-[(4-ethylsulfonylpiperazin-1-ium-1-yl)methyl]-1H-quinazolin-4-one Traditional Name: 2-[(4-esylpiperazin-1-ium-1-yl)methyl]-1H-quinazolin-4-one Formula: C15H21N4O3S+ MolecularWeight: 337.41724

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CC[NH+](CC1)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCS(=O)(=O)N1CC[NH+](CC1)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C15H20N4O3S/c1-2-23(21,22)19-9-7-18(8-10-19)11-14-16-13-6-4-3-5-12(13)15(20)17-14/h3-6H,2,7-11H2,1H3,(H,16,17,20)/p+1