N-(2-cyanoethyl)-2-(4-phenylazanylquinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-cyanoethyl)-2-(4-phenylazanylquinazolin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(4-anilinoquinazolin-2-yl)sulfanyl-N-(2-cyanoethyl)acetamide CAS Name: 2-[(4-anilino-2-quinazolinyl)thio]-N-(2-cyanoethyl)acetamide IUPAC Name: 2-(4-anilinoquinazolin-2-yl)sulfanyl-N-(2-cyanoethyl)acetamide Traditional Name: 2-[(4-anilinoquinazolin-2-yl)thio]-N-(2-cyanoethyl)acetamide Formula: C19H17N5OS MolecularWeight: 363.43618

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C32)SCC(=O)NCCC#N

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C32)SCC(=O)NCCC#N

InChI

InChI=1S/C19H17N5OS/c20-11-6-12-21-17(25)13-26-19-23-16-10-5-4-9-15(16)18(24-19)22-14-7-2-1-3-8-14/h1-5,7-10H,6,12-13H2,(H,21,25)(H,22,23,24)