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

Systemtic Name: N-butyl-2-(6-ethyl-2-phenyl-quinazolin-4-yl)sulfanyl-ethanamide Openeye Name: N-butyl-2-(6-ethyl-2-phenyl-quinazolin-4-yl)sulfanyl-acetamide CAS Name: N-butyl-2-[(6-ethyl-2-phenyl-4-quinazolinyl)thio]acetamide IUPAC Name: N-butyl-2-(6-ethyl-2-phenylquinazolin-4-yl)sulfanylacetamide Traditional Name: N-butyl-2-[(6-ethyl-2-phenyl-quinazolin-4-yl)thio]acetamide Formula: C22H25N3OS MolecularWeight: 379.5184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3OS/c1-3-5-13-23-20(26)15-27-22-18-14-16(4-2)11-12-19(18)24-21(25-22)17-9-7-6-8-10-17/h6-12,14H,3-5,13,15H2,1-2H3,(H,23,26)