6,7-dimethoxy-2-[4-[(5-oxidanidyl-4-phenyl-1,2,5-oxadiazol-5-ium-3-yl)sulfonyl]piperidin-1-yl]quinazolin-4-amine

Systemtic Name: 6,7-dimethoxy-2-[4-[(5-oxidanidyl-4-phenyl-1,2,5-oxadiazol-5-ium-3-yl)sulfonyl]piperidin-1-yl]quinazolin-4-amine Openeye Name: 6,7-dimethoxy-2-[4-[(5-oxido-4-phenyl-1,2,5-oxadiazol-5-ium-3-yl)sulfonyl]-1-piperidyl]quinazolin-4-amine CAS Name: 6,7-dimethoxy-2-[4-[(5-oxido-4-phenyl-1,2,5-oxadiazol-5-ium-3-yl)sulfonyl]-1-piperidinyl]-4-quinazolinamine IUPAC Name: 6,7-dimethoxy-2-[4-[(5-oxido-4-phenyl-1,2,5-oxadiazol-5-ium-3-yl)sulfonyl]piperidin-1-yl]quinazolin-4-amine Traditional Name: [6,7-dimethoxy-2-[4-(5-oxido-4-phenyl-furazan-5-ium-3-yl)sulfonylpiperidino]quinazolin-4-yl]amine Formula: C23H24N6O6S MolecularWeight: 512.53826

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCC(CC3)S(=O)(=O)C4=NO[N+](=C4C5=CC=CC=C5)[O-])N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCC(CC3)S(=O)(=O)C4=NO[N+](=C4C5=CC=CC=C5)[O-])N)OC

InChI

InChI=1S/C23H24N6O6S/c1-33-18-12-16-17(13-19(18)34-2)25-23(26-21(16)24)28-10-8-15(9-11-28)36(31,32)22-20(29(30)35-27-22)14-6-4-3-5-7-14/h3-7,12-13,15H,8-11H2,1-2H3,(H2,24,25,26)