N-[3-[6,7-dimethoxy-2-(methylamino)quinazolin-4-yl]phenyl]-4-methylsulfanyl-benzamide

Systemtic Name: N-[3-[6,7-dimethoxy-2-(methylamino)quinazolin-4-yl]phenyl]-4-methylsulfanyl-benzamide Openeye Name: N-[3-[6,7-dimethoxy-2-(methylamino)quinazolin-4-yl]phenyl]-4-methylsulfanyl-benzamide CAS Name: N-[3-[6,7-dimethoxy-2-(methylamino)-4-quinazolinyl]phenyl]-4-(methylthio)benzamide IUPAC Name: N-[3-[6,7-dimethoxy-2-(methylamino)quinazolin-4-yl]phenyl]-4-methylsulfanylbenzamide Traditional Name: N-[3-[6,7-dimethoxy-2-(methylamino)quinazolin-4-yl]phenyl]-4-(methylthio)benzamide Formula: C25H24N4O3S MolecularWeight: 460.54806

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC2=CC(=C(C=C2C(=N1)C3=CC(=CC=C3)NC(=O)C4=CC=C(C=C4)SC)OC)OC

Isomeric SMILES

CNC1=NC2=CC(=C(C=C2C(=N1)C3=CC(=CC=C3)NC(=O)C4=CC=C(C=C4)SC)OC)OC

InChI

InChI=1S/C25H24N4O3S/c1-26-25-28-20-14-22(32-3)21(31-2)13-19(20)23(29-25)16-6-5-7-17(12-16)27-24(30)15-8-10-18(33-4)11-9-15/h5-14H,1-4H3,(H,27,30)(H,26,28,29)