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

Systemtic Name: 2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-N-(2-methyl-4-pyrrolidin-1-yl-phenyl)ethanamide Openeye Name: 2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-N-(2-methyl-4-pyrrolidin-1-yl-phenyl)acetamide CAS Name: 2-[[4-(ethylamino)-2-quinazolinyl]thio]-N-[2-methyl-4-(1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-N-(2-methyl-4-pyrrolidin-1-ylphenyl)acetamide Traditional Name: 2-[[4-(ethylamino)quinazolin-2-yl]thio]-N-(2-methyl-4-pyrrolidino-phenyl)acetamide Formula: C23H27N5OS MolecularWeight: 421.55838

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC2=CC=CC=C21)SCC(=O)NC3=C(C=C(C=C3)N4CCCC4)C

Isomeric SMILES

CCNC1=NC(=NC2=CC=CC=C21)SCC(=O)NC3=C(C=C(C=C3)N4CCCC4)C

InChI

InChI=1S/C23H27N5OS/c1-3-24-22-18-8-4-5-9-20(18)26-23(27-22)30-15-21(29)25-19-11-10-17(14-16(19)2)28-12-6-7-13-28/h4-5,8-11,14H,3,6-7,12-13,15H2,1-2H3,(H,25,29)(H,24,26,27)