2-[6-methyl-4-oxidanylidene-2-[(4,6,8-trimethylquinazolin-2-yl)amino]-1H-pyrimidin-5-yl]ethanenitrile

Systemtic Name: 2-[6-methyl-4-oxidanylidene-2-[(4,6,8-trimethylquinazolin-2-yl)amino]-1H-pyrimidin-5-yl]ethanenitrile Openeye Name: 2-[6-methyl-4-oxo-2-[(4,6,8-trimethylquinazolin-2-yl)amino]-1H-pyrimidin-5-yl]acetonitrile CAS Name: 2-[6-methyl-4-oxo-2-[(4,6,8-trimethyl-2-quinazolinyl)amino]-1H-pyrimidin-5-yl]acetonitrile IUPAC Name: 2-[6-methyl-4-oxo-2-[(4,6,8-trimethylquinazolin-2-yl)amino]-1H-pyrimidin-5-yl]acetonitrile Traditional Name: 2-[4-keto-6-methyl-2-[(4,6,8-trimethylquinazolin-2-yl)amino]-1H-pyrimidin-5-yl]acetonitrile Formula: C18H18N6O MolecularWeight: 334.37512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=NC(=N2)NC3=NC(=O)C(=C(N3)C)CC#N)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=NC(=N2)NC3=NC(=O)C(=C(N3)C)CC#N)C)C

InChI

InChI=1S/C18H18N6O/c1-9-7-10(2)15-14(8-9)12(4)21-17(22-15)24-18-20-11(3)13(5-6-19)16(25)23-18/h7-8H,5H2,1-4H3,(H2,20,21,22,23,24,25)