[3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl 6-morpholin-4-ylpyridine-3-carboxylate

Systemtic Name: [3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl 6-morpholin-4-ylpyridine-3-carboxylate Openeye Name: [3-(2-amino-2-oxo-ethyl)-4-oxo-quinazolin-2-yl]methyl 6-morpholinopyridine-3-carboxylate CAS Name: 6-(4-morpholinyl)-3-pyridinecarboxylic acid [3-(2-amino-2-oxoethyl)-4-oxo-2-quinazolinyl]methyl ester IUPAC Name: [3-(2-amino-2-oxoethyl)-4-oxoquinazolin-2-yl]methyl 6-morpholin-4-ylpyridine-3-carboxylate Traditional Name: 6-morpholinonicotinic acid [3-(2-amino-2-keto-ethyl)-4-keto-quinazolin-2-yl]methyl ester Formula: C21H21N5O5 MolecularWeight: 423.42194

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC=C(C=C2)C(=O)OCC3=NC4=CC=CC=C4C(=O)N3CC(=O)N

Isomeric SMILES

C1COCCN1C2=NC=C(C=C2)C(=O)OCC3=NC4=CC=CC=C4C(=O)N3CC(=O)N

InChI

InChI=1S/C21H21N5O5/c22-17(27)12-26-19(24-16-4-2-1-3-15(16)20(26)28)13-31-21(29)14-5-6-18(23-11-14)25-7-9-30-10-8-25/h1-6,11H,7-10,12-13H2,(H2,22,27)