6-[4-[(3-ethynylphenyl)amino]quinazolin-6-yl]oxy-N-oxidanyl-hexanamide

Systemtic Name: 6-[4-[(3-ethynylphenyl)amino]quinazolin-6-yl]oxy-N-oxidanyl-hexanamide Openeye Name: 6-[4-(3-ethynylanilino)quinazolin-6-yl]oxyhexanehydroxamic acid CAS Name: 6-[[4-(3-ethynylanilino)-6-quinazolinyl]oxy]-N-hydroxyhexanamide IUPAC Name: 6-[4-(3-ethynylanilino)quinazolin-6-yl]oxy-N-hydroxyhexanamide Traditional Name: 6-[4-(3-ethynylanilino)quinazolin-6-yl]oxyhexanehydroxamic acid Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC2=NC=NC3=C2C=C(C=C3)OCCCCCC(=O)NO

Isomeric SMILES

C#CC1=CC(=CC=C1)NC2=NC=NC3=C2C=C(C=C3)OCCCCCC(=O)NO

InChI

InChI=1S/C22H22N4O3/c1-2-16-7-6-8-17(13-16)25-22-19-14-18(10-11-20(19)23-15-24-22)29-12-5-3-4-9-21(27)26-28/h1,6-8,10-11,13-15,28H,3-5,9,12H2,(H,26,27)(H,23,24,25)