N-(4-methylpiperazin-1-yl)-3-[(5E)-4-oxidanylidene-5-(phenylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]propanamide

Systemtic Name: N-(4-methylpiperazin-1-yl)-3-[(5E)-4-oxidanylidene-5-(phenylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]propanamide Openeye Name: 3-[(5E)-5-benzylidene-4-oxo-2-thioxo-thiazolidin-3-yl]-N-(4-methylpiperazin-1-yl)propanamide CAS Name: N-(4-methyl-1-piperazinyl)-3-[(5E)-4-oxo-5-(phenylmethylene)-2-sulfanylidene-3-thiazolidinyl]propanamide IUPAC Name: 3-[(5E)-5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(4-methylpiperazin-1-yl)propanamide Traditional Name: 3-[(5E)-5-benzal-4-keto-2-thioxo-thiazolidin-3-yl]-N-(4-methylpiperazino)propionamide Formula: C18H22N4O2S2 MolecularWeight: 390.52288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)NC(=O)CCN2C(=O)C(=CC3=CC=CC=C3)SC2=S

Isomeric SMILES

CN1CCN(CC1)NC(=O)CCN2C(=O)/C(=C\C3=CC=CC=C3)/SC2=S

InChI

InChI=1S/C18H22N4O2S2/c1-20-9-11-21(12-10-20)19-16(23)7-8-22-17(24)15(26-18(22)25)13-14-5-3-2-4-6-14/h2-6,13H,7-12H2,1H3,(H,19,23)/b15-13+