(2S)-N-(ethylcarbamoyl)-2-(4-phenylazanylquinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: (2S)-N-(ethylcarbamoyl)-2-(4-phenylazanylquinazolin-2-yl)sulfanyl-propanamide Openeye Name: (2S)-2-(4-anilinoquinazolin-2-yl)sulfanyl-N-(ethylcarbamoyl)propanamide CAS Name: (2S)-2-[(4-anilino-2-quinazolinyl)thio]-N-(ethylcarbamoyl)propanamide IUPAC Name: (2S)-2-(4-anilinoquinazolin-2-yl)sulfanyl-N-(ethylcarbamoyl)propanamide Traditional Name: (2S)-2-[(4-anilinoquinazolin-2-yl)thio]-N-(ethylcarbamoyl)propionamide Formula: C20H21N5O2S MolecularWeight: 395.47804

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C)SC1=NC2=CC=CC=C2C(=N1)NC3=CC=CC=C3

Isomeric SMILES

CCNC(=O)NC(=O)[C@H](C)SC1=NC2=CC=CC=C2C(=N1)NC3=CC=CC=C3

InChI

InChI=1S/C20H21N5O2S/c1-3-21-19(27)25-18(26)13(2)28-20-23-16-12-8-7-11-15(16)17(24-20)22-14-9-5-4-6-10-14/h4-13H,3H2,1-2H3,(H,22,23,24)(H2,21,25,26,27)/t13-/m0/s1