3-(2-methylpropyl)-5-[[4-(phenylmethyl)piperazin-4-ium-1-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: 3-(2-methylpropyl)-5-[[4-(phenylmethyl)piperazin-4-ium-1-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 5-[(4-benzylpiperazin-4-ium-1-yl)methylene]-3-isobutyl-2-thioxo-thiazolidin-4-one CAS Name: 3-(2-methylpropyl)-5-[[4-(phenylmethyl)-1-piperazin-4-iumyl]methylidene]-2-sulfanylidene-4-thiazolidinone IUPAC Name: 5-[(4-benzylpiperazin-4-ium-1-yl)methylidene]-3-(2-methylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 5-[(4-benzylpiperazin-4-ium-1-yl)methylene]-3-isobutyl-2-thioxo-thiazolidin-4-one Formula: C19H26N3OS2+ MolecularWeight: 376.55924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C(=CN2CC[NH+](CC2)CC3=CC=CC=C3)SC1=S

Isomeric SMILES

CC(C)CN1C(=O)C(=CN2CC[NH+](CC2)CC3=CC=CC=C3)SC1=S

InChI

InChI=1S/C19H25N3OS2/c1-15(2)12-22-18(23)17(25-19(22)24)14-21-10-8-20(9-11-21)13-16-6-4-3-5-7-16/h3-7,14-15H,8-13H2,1-2H3/p+1