2-[2-[[(2-methoxy-5-methyl-phenyl)methyl-methyl-amino]methyl]-4-oxidanylidene-quinazolin-3-yl]ethanenitrile

Systemtic Name: 2-[2-[[(2-methoxy-5-methyl-phenyl)methyl-methyl-amino]methyl]-4-oxidanylidene-quinazolin-3-yl]ethanenitrile Openeye Name: 2-[2-[[(2-methoxy-5-methyl-phenyl)methyl-methyl-amino]methyl]-4-oxo-quinazolin-3-yl]acetonitrile CAS Name: 2-[2-[[(2-methoxy-5-methylphenyl)methyl-methylamino]methyl]-4-oxo-3-quinazolinyl]acetonitrile IUPAC Name: 2-[2-[[(2-methoxy-5-methylphenyl)methyl-methylamino]methyl]-4-oxoquinazolin-3-yl]acetonitrile Traditional Name: 2-[4-keto-2-[[(2-methoxy-5-methyl-benzyl)-methyl-amino]methyl]quinazolin-3-yl]acetonitrile Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CN(C)CC2=NC3=CC=CC=C3C(=O)N2CC#N

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CN(C)CC2=NC3=CC=CC=C3C(=O)N2CC#N

InChI

InChI=1S/C21H22N4O2/c1-15-8-9-19(27-3)16(12-15)13-24(2)14-20-23-18-7-5-4-6-17(18)21(26)25(20)11-10-22/h4-9,12H,11,13-14H2,1-3H3