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

Systemtic Name: 2-[(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-N-[(2-methoxyphenyl)methyl]ethanamide Openeye Name: 2-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-N-[(2-methoxyphenyl)methyl]acetamide CAS Name: 2-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methylthio]-N-[(2-methoxyphenyl)methyl]acetamide IUPAC Name: 2-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-N-[(2-methoxyphenyl)methyl]acetamide Traditional Name: 2-[(4-keto-6,7-dimethoxy-1H-quinazolin-2-yl)methylthio]-N-o-anisyl-acetamide Formula: C21H23N3O5S MolecularWeight: 429.48942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC(=O)CSCC2=NC(=O)C3=CC(=C(C=C3N2)OC)OC

Isomeric SMILES

COC1=CC=CC=C1CNC(=O)CSCC2=NC(=O)C3=CC(=C(C=C3N2)OC)OC

InChI

InChI=1S/C21H23N3O5S/c1-27-16-7-5-4-6-13(16)10-22-20(25)12-30-11-19-23-15-9-18(29-3)17(28-2)8-14(15)21(26)24-19/h4-9H,10-12H2,1-3H3,(H,22,25)(H,23,24,26)