2-(4-phenylazanylquinazolin-2-yl)sulfanyl-N-prop-2-ynyl-ethanamide

Systemtic Name: 2-(4-phenylazanylquinazolin-2-yl)sulfanyl-N-prop-2-ynyl-ethanamide Openeye Name: 2-(4-anilinoquinazolin-2-yl)sulfanyl-N-prop-2-ynyl-acetamide CAS Name: 2-[(4-anilino-2-quinazolinyl)thio]-N-prop-2-ynylacetamide IUPAC Name: 2-(4-anilinoquinazolin-2-yl)sulfanyl-N-prop-2-ynylacetamide Traditional Name: 2-[(4-anilinoquinazolin-2-yl)thio]-N-propargyl-acetamide Formula: C19H16N4OS MolecularWeight: 348.42154

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)CSC1=NC2=CC=CC=C2C(=N1)NC3=CC=CC=C3

Isomeric SMILES

C#CCNC(=O)CSC1=NC2=CC=CC=C2C(=N1)NC3=CC=CC=C3

InChI

InChI=1S/C19H16N4OS/c1-2-12-20-17(24)13-25-19-22-16-11-7-6-10-15(16)18(23-19)21-14-8-4-3-5-9-14/h1,3-11H,12-13H2,(H,20,24)(H,21,22,23)