N-(2,6-dimethylphenyl)-2-[methyl(2-quinazolin-4-ylsulfanylethanoyl)amino]ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[methyl(2-quinazolin-4-ylsulfanylethanoyl)amino]ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[methyl-(2-quinazolin-4-ylsulfanylacetyl)amino]acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[methyl-[1-oxo-2-(4-quinazolinylthio)ethyl]amino]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[methyl-(2-quinazolin-4-ylsulfanylacetyl)amino]acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[methyl-[2-(quinazolin-4-ylthio)acetyl]amino]acetamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CN(C)C(=O)CSC2=NC=NC3=CC=CC=C32

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CN(C)C(=O)CSC2=NC=NC3=CC=CC=C32

InChI

InChI=1S/C21H22N4O2S/c1-14-7-6-8-15(2)20(14)24-18(26)11-25(3)19(27)12-28-21-16-9-4-5-10-17(16)22-13-23-21/h4-10,13H,11-12H2,1-3H3,(H,24,26)