dimethyl-[[4-[[4-(4-methylpiperazin-1-yl)phenyl]amino]quinazolin-2-yl]methyl]azanium

Systemtic Name: dimethyl-[[4-[[4-(4-methylpiperazin-1-yl)phenyl]amino]quinazolin-2-yl]methyl]azanium Openeye Name: dimethyl-[[4-[4-(4-methylpiperazin-1-yl)anilino]quinazolin-2-yl]methyl]ammonium CAS Name: dimethyl-[[4-[4-(4-methyl-1-piperazinyl)anilino]-2-quinazolinyl]methyl]ammonium IUPAC Name: dimethyl-[[4-[4-(4-methylpiperazin-1-yl)anilino]quinazolin-2-yl]methyl]azanium Traditional Name: dimethyl-[[4-[4-(4-methylpiperazino)anilino]quinazolin-2-yl]methyl]ammonium Formula: C22H29N6+ MolecularWeight: 377.50586

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=C(C=C2)NC3=NC(=NC4=CC=CC=C43)C[NH+](C)C

Isomeric SMILES

CN1CCN(CC1)C2=CC=C(C=C2)NC3=NC(=NC4=CC=CC=C43)C[NH+](C)C

InChI

InChI=1S/C22H28N6/c1-26(2)16-21-24-20-7-5-4-6-19(20)22(25-21)23-17-8-10-18(11-9-17)28-14-12-27(3)13-15-28/h4-11H,12-16H2,1-3H3,(H,23,24,25)/p+1