N-(2,3-dimethylphenyl)-2-[2-oxidanylidene-2-(quinolin-3-ylamino)ethyl]sulfinyl-ethanamide

Systemtic Name: N-(2,3-dimethylphenyl)-2-[2-oxidanylidene-2-(quinolin-3-ylamino)ethyl]sulfinyl-ethanamide Openeye Name: N-(2,3-dimethylphenyl)-2-[2-oxo-2-(3-quinolylamino)ethyl]sulfinyl-acetamide CAS Name: N-(2,3-dimethylphenyl)-2-[2-oxo-2-(3-quinolinylamino)ethyl]sulfinylacetamide IUPAC Name: N-(2,3-dimethylphenyl)-2-[2-oxo-2-(quinolin-3-ylamino)ethyl]sulfinylacetamide Traditional Name: N-(2,3-dimethylphenyl)-2-[2-keto-2-(3-quinolylamino)ethyl]sulfinyl-acetamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CS(=O)CC(=O)NC2=CC3=CC=CC=C3N=C2)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CS(=O)CC(=O)NC2=CC3=CC=CC=C3N=C2)C

InChI

InChI=1S/C21H21N3O3S/c1-14-6-5-9-18(15(14)2)24-21(26)13-28(27)12-20(25)23-17-10-16-7-3-4-8-19(16)22-11-17/h3-11H,12-13H2,1-2H3,(H,23,25)(H,24,26)