N-(2,6-diethylphenyl)-2-[1-(4-oxidanylidene-1H-quinazolin-2-yl)ethylsulfanyl]ethanamide

Systemtic Name: N-(2,6-diethylphenyl)-2-[1-(4-oxidanylidene-1H-quinazolin-2-yl)ethylsulfanyl]ethanamide Openeye Name: N-(2,6-diethylphenyl)-2-[1-(4-oxo-1H-quinazolin-2-yl)ethylsulfanyl]acetamide CAS Name: N-(2,6-diethylphenyl)-2-[1-(4-oxo-1H-quinazolin-2-yl)ethylthio]acetamide IUPAC Name: N-(2,6-diethylphenyl)-2-[1-(4-oxo-1H-quinazolin-2-yl)ethylsulfanyl]acetamide Traditional Name: N-(2,6-diethylphenyl)-2-[1-(4-keto-1H-quinazolin-2-yl)ethylthio]acetamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)CSC(C)C2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)CSC(C)C2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C22H25N3O2S/c1-4-15-9-8-10-16(5-2)20(15)24-19(26)13-28-14(3)21-23-18-12-7-6-11-17(18)22(27)25-21/h6-12,14H,4-5,13H2,1-3H3,(H,24,26)(H,23,25,27)