[3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl 2-methylsulfanyl-3-phenyl-imidazole-4-carboxylate

Systemtic Name: [3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl 2-methylsulfanyl-3-phenyl-imidazole-4-carboxylate Openeye Name: [3-(2-amino-2-oxo-ethyl)-4-oxo-quinazolin-2-yl]methyl 2-methylsulfanyl-3-phenyl-imidazole-4-carboxylate CAS Name: 2-(methylthio)-3-phenyl-4-imidazolecarboxylic acid [3-(2-amino-2-oxoethyl)-4-oxo-2-quinazolinyl]methyl ester IUPAC Name: [3-(2-amino-2-oxoethyl)-4-oxoquinazolin-2-yl]methyl 2-methylsulfanyl-3-phenylimidazole-4-carboxylate Traditional Name: 2-(methylthio)-3-phenyl-imidazole-4-carboxylic acid [3-(2-amino-2-keto-ethyl)-4-keto-quinazolin-2-yl]methyl ester Formula: C22H19N5O4S MolecularWeight: 449.48236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(N1C2=CC=CC=C2)C(=O)OCC3=NC4=CC=CC=C4C(=O)N3CC(=O)N

Isomeric SMILES

CSC1=NC=C(N1C2=CC=CC=C2)C(=O)OCC3=NC4=CC=CC=C4C(=O)N3CC(=O)N

InChI

InChI=1S/C22H19N5O4S/c1-32-22-24-11-17(27(22)14-7-3-2-4-8-14)21(30)31-13-19-25-16-10-6-5-9-15(16)20(29)26(19)12-18(23)28/h2-11H,12-13H2,1H3,(H2,23,28)