4-ethyl-N-[4-[(3-ethynylphenyl)amino]quinazolin-6-yl]piperazine-1-carboxamide

Systemtic Name: 4-ethyl-N-[4-[(3-ethynylphenyl)amino]quinazolin-6-yl]piperazine-1-carboxamide Openeye Name: 4-ethyl-N-[4-(3-ethynylanilino)quinazolin-6-yl]piperazine-1-carboxamide CAS Name: 4-ethyl-N-[4-(3-ethynylanilino)-6-quinazolinyl]-1-piperazinecarboxamide IUPAC Name: 4-ethyl-N-[4-(3-ethynylanilino)quinazolin-6-yl]piperazine-1-carboxamide Traditional Name: 4-ethyl-N-[4-(3-ethynylanilino)quinazolin-6-yl]piperazine-1-carboxamide Formula: C23H24N6O MolecularWeight: 400.47626

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)NC2=CC3=C(C=C2)N=CN=C3NC4=CC=CC(=C4)C#C

Isomeric SMILES

CCN1CCN(CC1)C(=O)NC2=CC3=C(C=C2)N=CN=C3NC4=CC=CC(=C4)C#C

InChI

InChI=1S/C23H24N6O/c1-3-17-6-5-7-18(14-17)26-22-20-15-19(8-9-21(20)24-16-25-22)27-23(30)29-12-10-28(4-2)11-13-29/h1,5-9,14-16H,4,10-13H2,2H3,(H,27,30)(H,24,25,26)