N-(4-cyanophenyl)-4-[6-methoxy-7-[2-(2H-1,2,3,4-tetrazol-3-ium-3-yl)ethoxy]quinazolin-4-yl]piperazine-1-carboxamide

Systemtic Name: N-(4-cyanophenyl)-4-[6-methoxy-7-[2-(2H-1,2,3,4-tetrazol-3-ium-3-yl)ethoxy]quinazolin-4-yl]piperazine-1-carboxamide Openeye Name: N-(4-cyanophenyl)-4-[6-methoxy-7-[2-(2H-tetrazol-3-ium-3-yl)ethoxy]quinazolin-4-yl]piperazine-1-carboxamide CAS Name: N-(4-cyanophenyl)-4-[6-methoxy-7-[2-(2H-tetrazol-3-ium-3-yl)ethoxy]-4-quinazolinyl]-1-piperazinecarboxamide IUPAC Name: N-(4-cyanophenyl)-4-[6-methoxy-7-[2-(2H-tetrazol-3-ium-3-yl)ethoxy]quinazolin-4-yl]piperazine-1-carboxamide Traditional Name: N-(4-cyanophenyl)-4-[6-methoxy-7-[2-(2H-tetrazol-3-ium-3-yl)ethoxy]quinazolin-4-yl]piperazine-1-carboxamide Formula: C24H25N10O3+ MolecularWeight: 501.5205

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)C#N)OCC[N+]5=NC=NN5

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)C#N)OCC[N+]5=NC=NN5

InChI

InChI=1S/C24H24N10O3/c1-36-21-12-19-20(13-22(21)37-11-10-34-29-16-28-31-34)26-15-27-23(19)32-6-8-33(9-7-32)24(35)30-18-4-2-17(14-25)3-5-18/h2-5,12-13,15-16H,6-11H2,1H3,(H,30,35)/p+1