2-[2-[3-(2,4-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoylamino]benzamide

Systemtic Name: 2-[2-[3-(2,4-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoylamino]benzamide Openeye Name: 2-[[2-[3-(2,4-dimethylphenyl)-4-oxo-quinazolin-2-yl]sulfanylacetyl]amino]benzamide CAS Name: 2-[[2-[[3-(2,4-dimethylphenyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]amino]benzamide IUPAC Name: 2-[[2-[3-(2,4-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]amino]benzamide Traditional Name: 2-[[2-[[3-(2,4-dimethylphenyl)-4-keto-quinazolin-2-yl]thio]acetyl]amino]benzamide Formula: C25H22N4O3S MolecularWeight: 458.53218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC=CC=C4C(=O)N)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC=CC=C4C(=O)N)C

InChI

InChI=1S/C25H22N4O3S/c1-15-11-12-21(16(2)13-15)29-24(32)18-8-4-6-10-20(18)28-25(29)33-14-22(30)27-19-9-5-3-7-17(19)23(26)31/h3-13H,14H2,1-2H3,(H2,26,31)(H,27,30)