2-[[3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methylsulfanyl]-N-phenyl-propanamide

Systemtic Name: 2-[[3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methylsulfanyl]-N-phenyl-propanamide Openeye Name: 2-[[3-(2-amino-2-oxo-ethyl)-4-oxo-quinazolin-2-yl]methylsulfanyl]-N-phenyl-propanamide CAS Name: 2-[[3-(2-amino-2-oxoethyl)-4-oxo-2-quinazolinyl]methylthio]-N-phenylpropanamide IUPAC Name: 2-[[3-(2-amino-2-oxoethyl)-4-oxoquinazolin-2-yl]methylsulfanyl]-N-phenylpropanamide Traditional Name: 2-[[3-(2-amino-2-keto-ethyl)-4-keto-quinazolin-2-yl]methylthio]-N-phenyl-propionamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)SCC2=NC3=CC=CC=C3C(=O)N2CC(=O)N

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1)SCC2=NC3=CC=CC=C3C(=O)N2CC(=O)N

InChI

InChI=1S/C20H20N4O3S/c1-13(19(26)22-14-7-3-2-4-8-14)28-12-18-23-16-10-6-5-9-15(16)20(27)24(18)11-17(21)25/h2-10,13H,11-12H2,1H3,(H2,21,25)(H,22,26)