N-(2-cyano-3-methyl-butan-2-yl)-2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(2-cyano-3-methyl-butan-2-yl)-2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-(1-cyano-1,2-dimethyl-propyl)-2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-propanamide CAS Name: N-(2-cyano-3-methylbutan-2-yl)-2-[[4-(ethylamino)-2-quinazolinyl]thio]propanamide IUPAC Name: N-(2-cyano-3-methylbutan-2-yl)-2-[4-(ethylamino)quinazolin-2-yl]sulfanylpropanamide Traditional Name: N-(1-cyano-1,2-dimethyl-propyl)-2-[[4-(ethylamino)quinazolin-2-yl]thio]propionamide Formula: C19H25N5OS MolecularWeight: 371.4997

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC2=CC=CC=C21)SC(C)C(=O)NC(C)(C#N)C(C)C

Isomeric SMILES

CCNC1=NC(=NC2=CC=CC=C21)SC(C)C(=O)NC(C)(C#N)C(C)C

InChI

InChI=1S/C19H25N5OS/c1-6-21-16-14-9-7-8-10-15(14)22-18(23-16)26-13(4)17(25)24-19(5,11-20)12(2)3/h7-10,12-13H,6H2,1-5H3,(H,24,25)(H,21,22,23)