N-[4-[(3-ethynylphenyl)amino]quinazolin-6-yl]-2-(4-methyl-1,4-diazepan-1-yl)ethanamide

Systemtic Name: N-[4-[(3-ethynylphenyl)amino]quinazolin-6-yl]-2-(4-methyl-1,4-diazepan-1-yl)ethanamide Openeye Name: N-[4-(3-ethynylanilino)quinazolin-6-yl]-2-(4-methyl-1,4-diazepan-1-yl)acetamide CAS Name: N-[4-(3-ethynylanilino)-6-quinazolinyl]-2-(4-methyl-1,4-diazepan-1-yl)acetamide IUPAC Name: N-[4-(3-ethynylanilino)quinazolin-6-yl]-2-(4-methyl-1,4-diazepan-1-yl)acetamide Traditional Name: N-[4-(3-ethynylanilino)quinazolin-6-yl]-2-(4-methyl-1,4-diazepan-1-yl)acetamide Formula: C24H26N6O MolecularWeight: 414.50284

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)CC(=O)NC2=CC3=C(C=C2)N=CN=C3NC4=CC=CC(=C4)C#C

Isomeric SMILES

CN1CCCN(CC1)CC(=O)NC2=CC3=C(C=C2)N=CN=C3NC4=CC=CC(=C4)C#C

InChI

InChI=1S/C24H26N6O/c1-3-18-6-4-7-19(14-18)28-24-21-15-20(8-9-22(21)25-17-26-24)27-23(31)16-30-11-5-10-29(2)12-13-30/h1,4,6-9,14-15,17H,5,10-13,16H2,2H3,(H,27,31)(H,25,26,28)