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

Systemtic Name: N-butyl-2-(6-chloranyl-2-phenyl-quinazolin-4-yl)sulfanyl-ethanamide Openeye Name: N-butyl-2-(6-chloro-2-phenyl-quinazolin-4-yl)sulfanyl-acetamide CAS Name: N-butyl-2-[(6-chloro-2-phenyl-4-quinazolinyl)thio]acetamide IUPAC Name: N-butyl-2-(6-chloro-2-phenylquinazolin-4-yl)sulfanylacetamide Traditional Name: N-butyl-2-[(6-chloro-2-phenyl-quinazolin-4-yl)thio]acetamide Formula: C20H20ClN3OS MolecularWeight: 385.9103

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20ClN3OS/c1-2-3-11-22-18(25)13-26-20-16-12-15(21)9-10-17(16)23-19(24-20)14-7-5-4-6-8-14/h4-10,12H,2-3,11,13H2,1H3,(H,22,25)