N-(2-methoxyethyl)-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]benzamide

Systemtic Name: N-(2-methoxyethyl)-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]benzamide Openeye Name: N-(2-methoxyethyl)-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]benzamide CAS Name: N-(2-methoxyethyl)-3-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]-N-[(4-oxo-1H-quinazolin-2-yl)methyl]benzamide IUPAC Name: N-(2-methoxyethyl)-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]benzamide Traditional Name: N-[(4-keto-1H-quinazolin-2-yl)methyl]-N-(2-methoxyethyl)-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-benzamide Formula: C24H30N5O5S+ MolecularWeight: 500.5905

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N(CCOC)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N(CCOC)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C24H29N5O5S/c1-27-10-12-29(13-11-27)35(32,33)19-7-5-6-18(16-19)24(31)28(14-15-34-2)17-22-25-21-9-4-3-8-20(21)23(30)26-22/h3-9,16H,10-15,17H2,1-2H3,(H,25,26,30)/p+1