2-[(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-N-propan-2-yl-ethanamide Openeye Name: 2-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-N-isopropyl-acetamide CAS Name: 2-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methylthio]-N-propan-2-ylacetamide IUPAC Name: 2-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-[(4-keto-6,7-dimethoxy-1H-quinazolin-2-yl)methylthio]acetamide Formula: C16H21N3O4S MolecularWeight: 351.42064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CSCC1=NC(=O)C2=CC(=C(C=C2N1)OC)OC

Isomeric SMILES

CC(C)NC(=O)CSCC1=NC(=O)C2=CC(=C(C=C2N1)OC)OC

InChI

InChI=1S/C16H21N3O4S/c1-9(2)17-15(20)8-24-7-14-18-11-6-13(23-4)12(22-3)5-10(11)16(21)19-14/h5-6,9H,7-8H2,1-4H3,(H,17,20)(H,18,19,21)