2-(4-oxidanylidenequinazolin-3-yl)-N-[4-(piperidin-1-ium-1-ylmethyl)-1,3-thiazol-2-yl]ethanamide

Systemtic Name: 2-(4-oxidanylidenequinazolin-3-yl)-N-[4-(piperidin-1-ium-1-ylmethyl)-1,3-thiazol-2-yl]ethanamide Openeye Name: 2-(4-oxoquinazolin-3-yl)-N-[4-(piperidin-1-ium-1-ylmethyl)thiazol-2-yl]acetamide CAS Name: 2-(4-oxo-3-quinazolinyl)-N-[4-(1-piperidin-1-iumylmethyl)-2-thiazolyl]acetamide IUPAC Name: 2-(4-oxoquinazolin-3-yl)-N-[4-(piperidin-1-ium-1-ylmethyl)-1,3-thiazol-2-yl]acetamide Traditional Name: 2-(4-ketoquinazolin-3-yl)-N-[4-(piperidin-1-ium-1-ylmethyl)thiazol-2-yl]acetamide Formula: C19H22N5O2S+ MolecularWeight: 384.47528

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CSC(=N2)NC(=O)CN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

C1CC[NH+](CC1)CC2=CSC(=N2)NC(=O)CN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C19H21N5O2S/c25-17(11-24-13-20-16-7-3-2-6-15(16)18(24)26)22-19-21-14(12-27-19)10-23-8-4-1-5-9-23/h2-3,6-7,12-13H,1,4-5,8-11H2,(H,21,22,25)/p+1