3-phenyl-5-[[4-(2-pyridin-2-ylethyl)piperazin-4-ium-1-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: 3-phenyl-5-[[4-(2-pyridin-2-ylethyl)piperazin-4-ium-1-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 3-phenyl-5-[[4-[2-(2-pyridyl)ethyl]piperazin-4-ium-1-yl]methylene]-2-thioxo-thiazolidin-4-one CAS Name: 3-phenyl-5-[[4-[2-(2-pyridinyl)ethyl]-1-piperazin-4-iumyl]methylidene]-2-sulfanylidene-4-thiazolidinone IUPAC Name: 3-phenyl-5-[[4-(2-pyridin-2-ylethyl)piperazin-4-ium-1-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 3-phenyl-5-[[4-[2-(2-pyridyl)ethyl]piperazin-4-ium-1-yl]methylene]-2-thioxo-thiazolidin-4-one Formula: C21H23N4OS2+ MolecularWeight: 411.56352

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC2=CC=CC=N2)C=C3C(=O)N(C(=S)S3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CCC2=CC=CC=N2)C=C3C(=O)N(C(=S)S3)C4=CC=CC=C4

InChI

InChI=1S/C21H22N4OS2/c26-20-19(28-21(27)25(20)18-7-2-1-3-8-18)16-24-14-12-23(13-15-24)11-9-17-6-4-5-10-22-17/h1-8,10,16H,9,11-15H2/p+1