6-[2-[[2-(2,3,4-trimethoxyphenyl)quinazolin-4-yl]amino]ethylamino]pyridine-3-carbonitrile

Systemtic Name: 6-[2-[[2-(2,3,4-trimethoxyphenyl)quinazolin-4-yl]amino]ethylamino]pyridine-3-carbonitrile Openeye Name: 6-[2-[[2-(2,3,4-trimethoxyphenyl)quinazolin-4-yl]amino]ethylamino]pyridine-3-carbonitrile CAS Name: 6-[2-[[2-(2,3,4-trimethoxyphenyl)-4-quinazolinyl]amino]ethylamino]-3-pyridinecarbonitrile IUPAC Name: 6-[2-[[2-(2,3,4-trimethoxyphenyl)quinazolin-4-yl]amino]ethylamino]pyridine-3-carbonitrile Traditional Name: 6-[2-[[2-(2,3,4-trimethoxyphenyl)quinazolin-4-yl]amino]ethylamino]nicotinonitrile Formula: C25H24N6O3 MolecularWeight: 456.49646

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C2=NC3=CC=CC=C3C(=N2)NCCNC4=NC=C(C=C4)C#N)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C2=NC3=CC=CC=C3C(=N2)NCCNC4=NC=C(C=C4)C#N)OC)OC

InChI

InChI=1S/C25H24N6O3/c1-32-20-10-9-18(22(33-2)23(20)34-3)25-30-19-7-5-4-6-17(19)24(31-25)28-13-12-27-21-11-8-16(14-26)15-29-21/h4-11,15H,12-13H2,1-3H3,(H,27,29)(H,28,30,31)