2-(8-methyl-4-oxidanylidene-quinazolin-3-yl)-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]ethanamide

Systemtic Name: 2-(8-methyl-4-oxidanylidene-quinazolin-3-yl)-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]ethanamide Openeye Name: 2-(8-methyl-4-oxo-quinazolin-3-yl)-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]acetamide CAS Name: 2-(8-methyl-4-oxo-3-quinazolinyl)-N-[4-(4-methyl-1-piperazin-4-iumyl)phenyl]acetamide IUPAC Name: 2-(8-methyl-4-oxoquinazolin-3-yl)-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]acetamide Traditional Name: 2-(4-keto-8-methyl-quinazolin-3-yl)-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]acetamide Formula: C22H26N5O2+ MolecularWeight: 392.47414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=CN(C2=O)CC(=O)NC3=CC=C(C=C3)N4CC[NH+](CC4)C

Isomeric SMILES

CC1=CC=CC2=C1N=CN(C2=O)CC(=O)NC3=CC=C(C=C3)N4CC[NH+](CC4)C

InChI

InChI=1S/C22H25N5O2/c1-16-4-3-5-19-21(16)23-15-27(22(19)29)14-20(28)24-17-6-8-18(9-7-17)26-12-10-25(2)11-13-26/h3-9,15H,10-14H2,1-2H3,(H,24,28)/p+1