3-(4,6-dimethoxypyrimidin-2-yl)-N-[[3-(dimethylamino)phenyl]methyl]-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 3-(4,6-dimethoxypyrimidin-2-yl)-N-[[3-(dimethylamino)phenyl]methyl]-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-(4,6-dimethoxypyrimidin-2-yl)-N-[[3-(dimethylamino)phenyl]methyl]-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-(4,6-dimethoxy-2-pyrimidinyl)-N-[[3-(dimethylamino)phenyl]methyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 3-(4,6-dimethoxypyrimidin-2-yl)-N-[[3-(dimethylamino)phenyl]methyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-(4,6-dimethoxypyrimidin-2-yl)-N-[3-(dimethylamino)benzyl]-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C24H24N6O4S MolecularWeight: 492.55016

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC(=C1)CNC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)C4=NC(=CC(=N4)OC)OC

Isomeric SMILES

CN(C)C1=CC=CC(=C1)CNC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)C4=NC(=CC(=N4)OC)OC

InChI

InChI=1S/C24H24N6O4S/c1-29(2)16-7-5-6-14(10-16)13-25-21(31)15-8-9-17-18(11-15)26-24(35)30(22(17)32)23-27-19(33-3)12-20(28-23)34-4/h5-12H,13H2,1-4H3,(H,25,31)(H,26,35)