2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-N-(3-ethylpent-1-yn-3-yl)ethanamide

Systemtic Name: 2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-N-(3-ethylpent-1-yn-3-yl)ethanamide Openeye Name: 2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-N-(1,1-diethylprop-2-ynyl)acetamide CAS Name: 2-[[4-(cyclopropylamino)-2-quinazolinyl]thio]-N-(3-ethylpent-1-yn-3-yl)acetamide IUPAC Name: 2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-N-(3-ethylpent-1-yn-3-yl)acetamide Traditional Name: 2-[[4-(cyclopropylamino)quinazolin-2-yl]thio]-N-(1,1-diethylprop-2-ynyl)acetamide Formula: C20H24N4OS MolecularWeight: 368.49576

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)CSC1=NC2=CC=CC=C2C(=N1)NC3CC3

Isomeric SMILES

CCC(CC)(C#C)NC(=O)CSC1=NC2=CC=CC=C2C(=N1)NC3CC3

InChI

InChI=1S/C20H24N4OS/c1-4-20(5-2,6-3)24-17(25)13-26-19-22-16-10-8-7-9-15(16)18(23-19)21-14-11-12-14/h1,7-10,14H,5-6,11-13H2,2-3H3,(H,24,25)(H,21,22,23)