N-(1-propan-2-ylpiperidin-1-ium-4-yl)-2-pyridin-3-yl-quinazolin-4-amine

Systemtic Name: N-(1-propan-2-ylpiperidin-1-ium-4-yl)-2-pyridin-3-yl-quinazolin-4-amine Openeye Name: N-(1-isopropylpiperidin-1-ium-4-yl)-2-(3-pyridyl)quinazolin-4-amine CAS Name: N-(1-propan-2-yl-4-piperidin-1-iumyl)-2-(3-pyridinyl)-4-quinazolinamine IUPAC Name: N-(1-propan-2-ylpiperidin-1-ium-4-yl)-2-pyridin-3-ylquinazolin-4-amine Traditional Name: (1-isopropylpiperidin-1-ium-4-yl)-[2-(3-pyridyl)quinazolin-4-yl]amine Formula: C21H26N5+ MolecularWeight: 348.46464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)NC2=NC(=NC3=CC=CC=C32)C4=CN=CC=C4

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)NC2=NC(=NC3=CC=CC=C32)C4=CN=CC=C4

InChI

InChI=1S/C21H25N5/c1-15(2)26-12-9-17(10-13-26)23-21-18-7-3-4-8-19(18)24-20(25-21)16-6-5-11-22-14-16/h3-8,11,14-15,17H,9-10,12-13H2,1-2H3,(H,23,24,25)/p+1