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

Systemtic Name: 3-[(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl-ethyl-amino]propanenitrile Openeye Name: 3-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-ethyl-amino]propanenitrile CAS Name: 3-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-ethylamino]propanenitrile IUPAC Name: 3-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-ethylamino]propanenitrile Traditional Name: 3-[ethyl-[(4-keto-6,7-dimethoxy-1H-quinazolin-2-yl)methyl]amino]propionitrile Formula: C16H20N4O3 MolecularWeight: 316.355

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCC#N)CC1=NC(=O)C2=CC(=C(C=C2N1)OC)OC

Isomeric SMILES

CCN(CCC#N)CC1=NC(=O)C2=CC(=C(C=C2N1)OC)OC

InChI

InChI=1S/C16H20N4O3/c1-4-20(7-5-6-17)10-15-18-12-9-14(23-3)13(22-2)8-11(12)16(21)19-15/h8-9H,4-5,7,10H2,1-3H3,(H,18,19,21)