N-(3-ethylpent-1-yn-3-yl)-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-ethylpent-1-yn-3-yl)-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(1,1-diethylprop-2-ynyl)-2-(3-methyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-(3-ethylpent-1-yn-3-yl)-2-[(3-methyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: N-(3-ethylpent-1-yn-3-yl)-2-(3-methyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(1,1-diethylprop-2-ynyl)-2-[(4-keto-3-methyl-quinazolin-2-yl)thio]acetamide Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C

Isomeric SMILES

CCC(CC)(C#C)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C

InChI

InChI=1S/C18H21N3O2S/c1-5-18(6-2,7-3)20-15(22)12-24-17-19-14-11-9-8-10-13(14)16(23)21(17)4/h1,8-11H,6-7,12H2,2-4H3,(H,20,22)