2-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)-3-(pyridin-1-ium-3-ylmethyl)-1,3-thiazolidin-4-one

Systemtic Name: 2-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)-3-(pyridin-1-ium-3-ylmethyl)-1,3-thiazolidin-4-one Openeye Name: 2-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]-3-(pyridin-1-ium-3-ylmethyl)thiazolidin-4-one CAS Name: 2-(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)-3-(3-pyridin-1-iumylmethyl)-4-thiazolidinone IUPAC Name: 2-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)-3-(pyridin-1-ium-3-ylmethyl)-1,3-thiazolidin-4-one Traditional Name: 2-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]-3-(pyridin-1-ium-3-ylmethyl)thiazolidin-4-one Formula: C22H19N4OS2+ MolecularWeight: 419.54246

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C(S1)C2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4)CC5=C[NH+]=CC=C5

Isomeric SMILES

C1C(=O)N(C(S1)C2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4)CC5=C[NH+]=CC=C5

InChI

InChI=1S/C22H18N4OS2/c27-20-15-29-22(25(20)13-16-6-4-10-23-12-16)18-14-26(17-7-2-1-3-8-17)24-21(18)19-9-5-11-28-19/h1-12,14,22H,13,15H2/p+1