4-[4-[[(2R)-oxolan-2-yl]methyl]piperazin-4-ium-1-yl]-2-pyridin-3-yl-quinazoline

Systemtic Name: 4-[4-[[(2R)-oxolan-2-yl]methyl]piperazin-4-ium-1-yl]-2-pyridin-3-yl-quinazoline Openeye Name: 2-(3-pyridyl)-4-[4-[[(2R)-tetrahydrofuran-2-yl]methyl]piperazin-4-ium-1-yl]quinazoline CAS Name: 4-[4-[[(2R)-2-oxolanyl]methyl]-1-piperazin-4-iumyl]-2-(3-pyridinyl)quinazoline IUPAC Name: 4-[4-[[(2R)-oxolan-2-yl]methyl]piperazin-4-ium-1-yl]-2-pyridin-3-ylquinazoline Traditional Name: 2-(3-pyridyl)-4-[4-[[(2R)-tetrahydrofuran-2-yl]methyl]piperazin-4-ium-1-yl]quinazoline Formula: C22H26N5O+ MolecularWeight: 376.47474

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)C[NH+]2CCN(CC2)C3=NC(=NC4=CC=CC=C43)C5=CN=CC=C5

Isomeric SMILES

C1C[C@@H](OC1)C[NH+]2CCN(CC2)C3=NC(=NC4=CC=CC=C43)C5=CN=CC=C5

InChI

InChI=1S/C22H25N5O/c1-2-8-20-19(7-1)22(25-21(24-20)17-5-3-9-23-15-17)27-12-10-26(11-13-27)16-18-6-4-14-28-18/h1-3,5,7-9,15,18H,4,6,10-14,16H2/p+1/t18-/m1/s1