2-piperidin-1-ium-1-yl-N-[(5R)-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-yl]ethanamide

Systemtic Name: 2-piperidin-1-ium-1-yl-N-[(5R)-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-yl]ethanamide Openeye Name: 2-piperidin-1-ium-1-yl-N-[(5R)-2-(3-pyridyl)-5,6,7,8-tetrahydroquinazolin-5-yl]acetamide CAS Name: 2-(1-piperidin-1-iumyl)-N-[(5R)-2-(3-pyridinyl)-5,6,7,8-tetrahydroquinazolin-5-yl]acetamide IUPAC Name: 2-piperidin-1-ium-1-yl-N-[(5R)-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-yl]acetamide Traditional Name: 2-piperidin-1-ium-1-yl-N-[(5R)-2-(3-pyridyl)-5,6,7,8-tetrahydroquinazolin-5-yl]acetamide Formula: C20H26N5O+ MolecularWeight: 352.45334

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(=O)NC2CCCC3=NC(=NC=C23)C4=CN=CC=C4

Isomeric SMILES

C1CC[NH+](CC1)CC(=O)N[C@@H]2CCCC3=NC(=NC=C23)C4=CN=CC=C4

InChI

InChI=1S/C20H25N5O/c26-19(14-25-10-2-1-3-11-25)23-17-7-4-8-18-16(17)13-22-20(24-18)15-6-5-9-21-12-15/h5-6,9,12-13,17H,1-4,7-8,10-11,14H2,(H,23,26)/p+1/t17-/m1/s1