2-(3,5-dimethylphenoxy)-N-[(2-morpholin-4-ylphenyl)carbamothioyl]ethanamide

Systemtic Name: 2-(3,5-dimethylphenoxy)-N-[(2-morpholin-4-ylphenyl)carbamothioyl]ethanamide Openeye Name: 2-(3,5-dimethylphenoxy)-N-[(2-morpholinophenyl)carbamothioyl]acetamide CAS Name: 2-(3,5-dimethylphenoxy)-N-[[2-(4-morpholinyl)anilino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(3,5-dimethylphenoxy)-N-[(2-morpholin-4-ylphenyl)carbamothioyl]acetamide Traditional Name: 2-(3,5-dimethylphenoxy)-N-[(2-morpholinophenyl)thiocarbamoyl]acetamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)NC(=S)NC2=CC=CC=C2N3CCOCC3)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)NC(=S)NC2=CC=CC=C2N3CCOCC3)C

InChI

InChI=1S/C21H25N3O3S/c1-15-11-16(2)13-17(12-15)27-14-20(25)23-21(28)22-18-5-3-4-6-19(18)24-7-9-26-10-8-24/h3-6,11-13H,7-10,14H2,1-2H3,(H2,22,23,25,28)