N-[4-(morpholin-4-ium-4-ylmethyl)-1,3-thiazol-2-yl]-3-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide

Systemtic Name: N-[4-(morpholin-4-ium-4-ylmethyl)-1,3-thiazol-2-yl]-3-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide Openeye Name: N-[4-(morpholin-4-ium-4-ylmethyl)thiazol-2-yl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide CAS Name: N-[4-(4-morpholin-4-iumylmethyl)-2-thiazolyl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide IUPAC Name: N-[4-(morpholin-4-ium-4-ylmethyl)-1,3-thiazol-2-yl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide Traditional Name: 3-(4-keto-1H-quinazolin-2-yl)-N-[4-(morpholin-4-ium-4-ylmethyl)thiazol-2-yl]propionamide Formula: C19H22N5O3S+ MolecularWeight: 400.47468

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CSC(=N2)NC(=O)CCC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C1COCC[NH+]1CC2=CSC(=N2)NC(=O)CCC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C19H21N5O3S/c25-17(6-5-16-21-15-4-2-1-3-14(15)18(26)22-16)23-19-20-13(12-28-19)11-24-7-9-27-10-8-24/h1-4,12H,5-11H2,(H,20,23,25)(H,21,22,26)/p+1