4-[[(2-sulfanylidene-1H-quinazolin-4-yl)amino]methyl]-N-(3,4,5-trimethoxyphenyl)benzamide

Systemtic Name: 4-[[(2-sulfanylidene-1H-quinazolin-4-yl)amino]methyl]-N-(3,4,5-trimethoxyphenyl)benzamide Openeye Name: 4-[[(2-thioxo-1H-quinazolin-4-yl)amino]methyl]-N-(3,4,5-trimethoxyphenyl)benzamide CAS Name: 4-[[(2-sulfanylidene-1H-quinazolin-4-yl)amino]methyl]-N-(3,4,5-trimethoxyphenyl)benzamide IUPAC Name: 4-[[(2-sulfanylidene-1H-quinazolin-4-yl)amino]methyl]-N-(3,4,5-trimethoxyphenyl)benzamide Traditional Name: 4-[[(2-thioxo-1H-quinazolin-4-yl)amino]methyl]-N-(3,4,5-trimethoxyphenyl)benzamide Formula: C25H24N4O4S MolecularWeight: 476.54746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=O)C2=CC=C(C=C2)CNC3=NC(=S)NC4=CC=CC=C43

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=O)C2=CC=C(C=C2)CNC3=NC(=S)NC4=CC=CC=C43

InChI

InChI=1S/C25H24N4O4S/c1-31-20-12-17(13-21(32-2)22(20)33-3)27-24(30)16-10-8-15(9-11-16)14-26-23-18-6-4-5-7-19(18)28-25(34)29-23/h4-13H,14H2,1-3H3,(H,27,30)(H2,26,28,29,34)