2-(6-chloranyl-2-phenyl-quinazolin-4-yl)sulfanyl-N-(3-ethoxypropyl)ethanamide

Systemtic Name: 2-(6-chloranyl-2-phenyl-quinazolin-4-yl)sulfanyl-N-(3-ethoxypropyl)ethanamide Openeye Name: 2-(6-chloro-2-phenyl-quinazolin-4-yl)sulfanyl-N-(3-ethoxypropyl)acetamide CAS Name: 2-[(6-chloro-2-phenyl-4-quinazolinyl)thio]-N-(3-ethoxypropyl)acetamide IUPAC Name: 2-(6-chloro-2-phenylquinazolin-4-yl)sulfanyl-N-(3-ethoxypropyl)acetamide Traditional Name: 2-[(6-chloro-2-phenyl-quinazolin-4-yl)thio]-N-(3-ethoxypropyl)acetamide Formula: C21H22ClN3O2S MolecularWeight: 415.93628

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)CSC1=NC(=NC2=C1C=C(C=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

CCOCCCNC(=O)CSC1=NC(=NC2=C1C=C(C=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C21H22ClN3O2S/c1-2-27-12-6-11-23-19(26)14-28-21-17-13-16(22)9-10-18(17)24-20(25-21)15-7-4-3-5-8-15/h3-5,7-10,13H,2,6,11-12,14H2,1H3,(H,23,26)