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

Systemtic Name: 2-(4-phenylazanylquinazolin-2-yl)sulfanyl-N-(prop-2-enylcarbamoyl)ethanamide Openeye Name: N-(allylcarbamoyl)-2-(4-anilinoquinazolin-2-yl)sulfanyl-acetamide CAS Name: 2-[(4-anilino-2-quinazolinyl)thio]-N-[oxo-(prop-2-enylamino)methyl]acetamide IUPAC Name: 2-(4-anilinoquinazolin-2-yl)sulfanyl-N-(prop-2-enylcarbamoyl)acetamide Traditional Name: N-(allylcarbamoyl)-2-[(4-anilinoquinazolin-2-yl)thio]acetamide Formula: C20H19N5O2S MolecularWeight: 393.46216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19N5O2S/c1-2-12-21-19(27)24-17(26)13-28-20-23-16-11-7-6-10-15(16)18(25-20)22-14-8-4-3-5-9-14/h2-11H,1,12-13H2,(H,22,23,25)(H2,21,24,26,27)