2-(3-morpholin-4-ylpropylcarbamothioylamino)-N-(2,4,6-trimethylphenyl)ethanamide

Systemtic Name: 2-(3-morpholin-4-ylpropylcarbamothioylamino)-N-(2,4,6-trimethylphenyl)ethanamide Openeye Name: 2-(3-morpholinopropylcarbamothioylamino)-N-(2,4,6-trimethylphenyl)acetamide CAS Name: 2-[[[3-(4-morpholinyl)propylamino]-sulfanylidenemethyl]amino]-N-(2,4,6-trimethylphenyl)acetamide IUPAC Name: 2-(3-morpholin-4-ylpropylcarbamothioylamino)-N-(2,4,6-trimethylphenyl)acetamide Traditional Name: N-mesityl-2-(3-morpholinopropylthiocarbamoylamino)acetamide Formula: C19H30N4O2S MolecularWeight: 378.5321

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)CNC(=S)NCCCN2CCOCC2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)CNC(=S)NCCCN2CCOCC2)C

InChI

InChI=1S/C19H30N4O2S/c1-14-11-15(2)18(16(3)12-14)22-17(24)13-21-19(26)20-5-4-6-23-7-9-25-10-8-23/h11-12H,4-10,13H2,1-3H3,(H,22,24)(H2,20,21,26)