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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCC(=O)NC(=S)NC2=CC=C(C=C2)N3CCOCC3

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCC(=O)NC(=S)NC2=CC=C(C=C2)N3CCOCC3

InChI

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