N-(3,5-dimethylphenyl)-2-(8-ethyl-2-phenyl-quinazolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(3,5-dimethylphenyl)-2-(8-ethyl-2-phenyl-quinazolin-4-yl)sulfanyl-ethanamide Openeye Name: N-(3,5-dimethylphenyl)-2-(8-ethyl-2-phenyl-quinazolin-4-yl)sulfanyl-acetamide CAS Name: N-(3,5-dimethylphenyl)-2-[(8-ethyl-2-phenyl-4-quinazolinyl)thio]acetamide IUPAC Name: N-(3,5-dimethylphenyl)-2-(8-ethyl-2-phenylquinazolin-4-yl)sulfanylacetamide Traditional Name: N-(3,5-dimethylphenyl)-2-[(8-ethyl-2-phenyl-quinazolin-4-yl)thio]acetamide Formula: C26H25N3OS MolecularWeight: 427.5612

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1N=C(N=C2SCC(=O)NC3=CC(=CC(=C3)C)C)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC=CC2=C1N=C(N=C2SCC(=O)NC3=CC(=CC(=C3)C)C)C4=CC=CC=C4

InChI

InChI=1S/C26H25N3OS/c1-4-19-11-8-12-22-24(19)28-25(20-9-6-5-7-10-20)29-26(22)31-16-23(30)27-21-14-17(2)13-18(3)15-21/h5-15H,4,16H2,1-3H3,(H,27,30)