N-[(3,4-dimethoxyphenyl)methyl]-2-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]ethanamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]ethanamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]acetamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[(4-oxo-1H-quinazolin-2-yl)methylthio]acetamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]acetamide Traditional Name: 2-[(4-keto-1H-quinazolin-2-yl)methylthio]-N-veratryl-acetamide Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)CSCC2=NC(=O)C3=CC=CC=C3N2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)CSCC2=NC(=O)C3=CC=CC=C3N2)OC

InChI

InChI=1S/C20H21N3O4S/c1-26-16-8-7-13(9-17(16)27-2)10-21-19(24)12-28-11-18-22-15-6-4-3-5-14(15)20(25)23-18/h3-9H,10-12H2,1-2H3,(H,21,24)(H,22,23,25)