N-(3-ethylpent-1-yn-3-yl)-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide

Systemtic Name: N-(3-ethylpent-1-yn-3-yl)-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Openeye Name: N-(1,1-diethylprop-2-ynyl)-3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanamide CAS Name: N-(3-ethylpent-1-yn-3-yl)-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide IUPAC Name: N-(3-ethylpent-1-yn-3-yl)-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Traditional Name: N-(1,1-diethylprop-2-ynyl)-3-(4-keto-2-thioxo-1H-quinazolin-3-yl)propionamide Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)CCN1C(=O)C2=CC=CC=C2NC1=S

Isomeric SMILES

CCC(CC)(C#C)NC(=O)CCN1C(=O)C2=CC=CC=C2NC1=S

InChI

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