2-ethyl-4-methyl-6-(4-methylpiperazin-1-yl)-3-oxidanidyl-quinazolin-3-ium

Systemtic Name: 2-ethyl-4-methyl-6-(4-methylpiperazin-1-yl)-3-oxidanidyl-quinazolin-3-ium Openeye Name: 2-ethyl-4-methyl-6-(4-methylpiperazin-1-yl)-3-oxido-quinazolin-3-ium CAS Name: 2-ethyl-4-methyl-6-(4-methyl-1-piperazinyl)-3-oxidoquinazolin-3-ium IUPAC Name: 2-ethyl-4-methyl-6-(4-methylpiperazin-1-yl)-3-oxidoquinazolin-3-ium Traditional Name: 2-ethyl-4-methyl-6-(4-methylpiperazino)-3-oxido-quinazolin-3-ium Formula: C16H22N4O MolecularWeight: 286.37208

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=C(C=C2)N3CCN(CC3)C)C(=[N+]1[O-])C

Isomeric SMILES

CCC1=NC2=C(C=C(C=C2)N3CCN(CC3)C)C(=[N+]1[O-])C

InChI

InChI=1S/C16H22N4O/c1-4-16-17-15-6-5-13(11-14(15)12(2)20(16)21)19-9-7-18(3)8-10-19/h5-6,11H,4,7-10H2,1-3H3