N-[3-[(E)-C-methyl-N-(2-morpholin-4-ylethylcarbamothioylamino)carbonimidoyl]phenyl]ethanamide

Systemtic Name: N-[3-[(E)-C-methyl-N-(2-morpholin-4-ylethylcarbamothioylamino)carbonimidoyl]phenyl]ethanamide Openeye Name: N-[3-[(E)-C-methyl-N-(2-morpholinoethylcarbamothioylamino)carbonimidoyl]phenyl]acetamide CAS Name: N-[3-[(1E)-1-[[[2-(4-morpholinyl)ethylamino]-sulfanylidenemethyl]hydrazinylidene]ethyl]phenyl]acetamide IUPAC Name: N-[3-[(E)-C-methyl-N-(2-morpholin-4-ylethylcarbamothioylamino)carbonimidoyl]phenyl]acetamide Traditional Name: N-[3-[(E)-C-methyl-N-(2-morpholinoethylthiocarbamoylamino)carbonimidoyl]phenyl]acetamide Formula: C17H25N5O2S MolecularWeight: 363.4777

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NCCN1CCOCC1)C2=CC(=CC=C2)NC(=O)C

Isomeric SMILES

C/C(=N\NC(=S)NCCN1CCOCC1)/C2=CC(=CC=C2)NC(=O)C

InChI

InChI=1S/C17H25N5O2S/c1-13(15-4-3-5-16(12-15)19-14(2)23)20-21-17(25)18-6-7-22-8-10-24-11-9-22/h3-5,12H,6-11H2,1-2H3,(H,19,23)(H2,18,21,25)/b20-13+