N,N-diethyl-3-[[6-(3-methyl-3-oxidanyl-but-1-ynyl)quinazolin-4-yl]amino]benzamide

Systemtic Name: N,N-diethyl-3-[[6-(3-methyl-3-oxidanyl-but-1-ynyl)quinazolin-4-yl]amino]benzamide Openeye Name: N,N-diethyl-3-[[6-(3-hydroxy-3-methyl-but-1-ynyl)quinazolin-4-yl]amino]benzamide CAS Name: N,N-diethyl-3-[[6-(3-hydroxy-3-methylbut-1-ynyl)-4-quinazolinyl]amino]benzamide IUPAC Name: N,N-diethyl-3-[[6-(3-hydroxy-3-methylbut-1-ynyl)quinazolin-4-yl]amino]benzamide Traditional Name: N,N-diethyl-3-[[6-(3-hydroxy-3-methyl-but-1-ynyl)quinazolin-4-yl]amino]benzamide Formula: C24H26N4O2 MolecularWeight: 402.48884

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC=C1)NC2=NC=NC3=C2C=C(C=C3)C#CC(C)(C)O

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC=C1)NC2=NC=NC3=C2C=C(C=C3)C#CC(C)(C)O

InChI

InChI=1S/C24H26N4O2/c1-5-28(6-2)23(29)18-8-7-9-19(15-18)27-22-20-14-17(12-13-24(3,4)30)10-11-21(20)25-16-26-22/h7-11,14-16,30H,5-6H2,1-4H3,(H,25,26,27)