N-(2,3-dimethylphenyl)-2-[2-(2-methylquinazolin-4-yl)sulfanylethanoylamino]ethanamide

Systemtic Name: N-(2,3-dimethylphenyl)-2-[2-(2-methylquinazolin-4-yl)sulfanylethanoylamino]ethanamide Openeye Name: N-(2,3-dimethylphenyl)-2-[[2-(2-methylquinazolin-4-yl)sulfanylacetyl]amino]acetamide CAS Name: N-(2,3-dimethylphenyl)-2-[[2-[(2-methyl-4-quinazolinyl)thio]-1-oxoethyl]amino]acetamide IUPAC Name: N-(2,3-dimethylphenyl)-2-[[2-(2-methylquinazolin-4-yl)sulfanylacetyl]amino]acetamide Traditional Name: N-(2,3-dimethylphenyl)-2-[[2-[(2-methylquinazolin-4-yl)thio]acetyl]amino]acetamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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