N-(4-ethylphenyl)-2-(4-oxidanylidene-3-phenethyl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-ethylphenyl)-2-(4-oxidanylidene-3-phenethyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-ethylphenyl)-2-(4-oxo-3-phenethyl-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-(4-ethylphenyl)-2-[(4-oxo-3-phenethyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-(4-ethylphenyl)-2-(4-oxo-3-phenethylquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(4-ethylphenyl)-2-[(4-keto-3-phenethyl-quinazolin-2-yl)thio]acetamide Formula: C26H25N3O2S MolecularWeight: 443.5606

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCC4=CC=CC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCC4=CC=CC=C4

InChI

InChI=1S/C26H25N3O2S/c1-2-19-12-14-21(15-13-19)27-24(30)18-32-26-28-23-11-7-6-10-22(23)25(31)29(26)17-16-20-8-4-3-5-9-20/h3-15H,2,16-18H2,1H3,(H,27,30)