2-[2-[[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]methyl]-4-oxidanylidene-quinazolin-3-yl]ethanenitrile

Systemtic Name: 2-[2-[[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]methyl]-4-oxidanylidene-quinazolin-3-yl]ethanenitrile Openeye Name: 2-[2-[[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]methyl]-4-oxo-quinazolin-3-yl]acetonitrile CAS Name: 2-[2-[[2-(3,4-dimethoxyphenyl)ethyl-methylamino]methyl]-4-oxo-3-quinazolinyl]acetonitrile IUPAC Name: 2-[2-[[2-(3,4-dimethoxyphenyl)ethyl-methylamino]methyl]-4-oxoquinazolin-3-yl]acetonitrile Traditional Name: 2-[2-[[homoveratryl(methyl)amino]methyl]-4-keto-quinazolin-3-yl]acetonitrile Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)CC2=NC3=CC=CC=C3C(=O)N2CC#N

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)CC2=NC3=CC=CC=C3C(=O)N2CC#N

InChI

InChI=1S/C22H24N4O3/c1-25(12-10-16-8-9-19(28-2)20(14-16)29-3)15-21-24-18-7-5-4-6-17(18)22(27)26(21)13-11-23/h4-9,14H,10,12-13,15H2,1-3H3