N-(2,3-dimethylphenyl)-2-(2-quinolin-2-ylsulfanylethanoylamino)ethanamide

Systemtic Name: N-(2,3-dimethylphenyl)-2-(2-quinolin-2-ylsulfanylethanoylamino)ethanamide Openeye Name: N-(2,3-dimethylphenyl)-2-[[2-(2-quinolylsulfanyl)acetyl]amino]acetamide CAS Name: N-(2,3-dimethylphenyl)-2-[[1-oxo-2-(2-quinolinylthio)ethyl]amino]acetamide IUPAC Name: N-(2,3-dimethylphenyl)-2-[(2-quinolin-2-ylsulfanylacetyl)amino]acetamide Traditional Name: N-(2,3-dimethylphenyl)-2-[[2-(2-quinolylthio)acetyl]amino]acetamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CNC(=O)CSC2=NC3=CC=CC=C3C=C2)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CNC(=O)CSC2=NC3=CC=CC=C3C=C2)C

InChI

InChI=1S/C21H21N3O2S/c1-14-6-5-9-17(15(14)2)23-19(25)12-22-20(26)13-27-21-11-10-16-7-3-4-8-18(16)24-21/h3-11H,12-13H2,1-2H3,(H,22,26)(H,23,25)