2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-N-(2-pyrrolidin-1-ylphenyl)ethanamide

Systemtic Name: 2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-N-(2-pyrrolidin-1-ylphenyl)ethanamide Openeye Name: 2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-N-(2-pyrrolidin-1-ylphenyl)acetamide CAS Name: 2-[[4-(ethylamino)-2-quinazolinyl]thio]-N-[2-(1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-N-(2-pyrrolidin-1-ylphenyl)acetamide Traditional Name: 2-[[4-(ethylamino)quinazolin-2-yl]thio]-N-(2-pyrrolidinophenyl)acetamide Formula: C22H25N5OS MolecularWeight: 407.5318

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC2=CC=CC=C21)SCC(=O)NC3=CC=CC=C3N4CCCC4

Isomeric SMILES

CCNC1=NC(=NC2=CC=CC=C21)SCC(=O)NC3=CC=CC=C3N4CCCC4

InChI

InChI=1S/C22H25N5OS/c1-2-23-21-16-9-3-4-10-17(16)25-22(26-21)29-15-20(28)24-18-11-5-6-12-19(18)27-13-7-8-14-27/h3-6,9-12H,2,7-8,13-15H2,1H3,(H,24,28)(H,23,25,26)