2-[1-(4-oxidanylidene-1H-quinazolin-2-yl)ethylsulfanyl]-N-(2-propan-2-ylphenyl)ethanamide

Systemtic Name: 2-[1-(4-oxidanylidene-1H-quinazolin-2-yl)ethylsulfanyl]-N-(2-propan-2-ylphenyl)ethanamide Openeye Name: N-(2-isopropylphenyl)-2-[1-(4-oxo-1H-quinazolin-2-yl)ethylsulfanyl]acetamide CAS Name: 2-[1-(4-oxo-1H-quinazolin-2-yl)ethylthio]-N-(2-propan-2-ylphenyl)acetamide IUPAC Name: 2-[1-(4-oxo-1H-quinazolin-2-yl)ethylsulfanyl]-N-(2-propan-2-ylphenyl)acetamide Traditional Name: 2-[1-(4-keto-1H-quinazolin-2-yl)ethylthio]-N-o-cumenyl-acetamide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=O)CSC(C)C2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CC(C)C1=CC=CC=C1NC(=O)CSC(C)C2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C21H23N3O2S/c1-13(2)15-8-4-6-10-17(15)22-19(25)12-27-14(3)20-23-18-11-7-5-9-16(18)21(26)24-20/h4-11,13-14H,12H2,1-3H3,(H,22,25)(H,23,24,26)