N-tert-butyl-2-(4-phenylazanylquinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-tert-butyl-2-(4-phenylazanylquinazolin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(4-anilinoquinazolin-2-yl)sulfanyl-N-tert-butyl-acetamide CAS Name: 2-[(4-anilino-2-quinazolinyl)thio]-N-tert-butylacetamide IUPAC Name: 2-(4-anilinoquinazolin-2-yl)sulfanyl-N-tert-butylacetamide Traditional Name: 2-[(4-anilinoquinazolin-2-yl)thio]-N-tert-butyl-acetamide Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4OS/c1-20(2,3)24-17(25)13-26-19-22-16-12-8-7-11-15(16)18(23-19)21-14-9-5-4-6-10-14/h4-12H,13H2,1-3H3,(H,24,25)(H,21,22,23)