3-[[(6,7-dimethoxy-5-methyl-4-oxidanylidene-1H-quinazolin-2-yl)-methyl-amino]methyl]benzenecarbonitrile

Systemtic Name: 3-[[(6,7-dimethoxy-5-methyl-4-oxidanylidene-1H-quinazolin-2-yl)-methyl-amino]methyl]benzenecarbonitrile Openeye Name: 3-[[(6,7-dimethoxy-5-methyl-4-oxo-1H-quinazolin-2-yl)-methyl-amino]methyl]benzonitrile CAS Name: 3-[[(6,7-dimethoxy-5-methyl-4-oxo-1H-quinazolin-2-yl)-methylamino]methyl]benzonitrile IUPAC Name: 3-[[(6,7-dimethoxy-5-methyl-4-oxo-1H-quinazolin-2-yl)-methylamino]methyl]benzonitrile Traditional Name: 3-[[(4-keto-6,7-dimethoxy-5-methyl-1H-quinazolin-2-yl)-methyl-amino]methyl]benzonitrile Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1OC)OC)NC(=NC2=O)N(C)CC3=CC=CC(=C3)C#N

Isomeric SMILES

CC1=C2C(=CC(=C1OC)OC)NC(=NC2=O)N(C)CC3=CC=CC(=C3)C#N

InChI

InChI=1S/C20H20N4O3/c1-12-17-15(9-16(26-3)18(12)27-4)22-20(23-19(17)25)24(2)11-14-7-5-6-13(8-14)10-21/h5-9H,11H2,1-4H3,(H,22,23,25)