1-[1,1-bis(oxidanylidene)thiolan-3-yl]-3-thiophen-2-yl-pyrazole-4-carbaldehyde

Systemtic Name: 1-[1,1-bis(oxidanylidene)thiolan-3-yl]-3-thiophen-2-yl-pyrazole-4-carbaldehyde Openeye Name: 1-(1,1-dioxothiolan-3-yl)-3-(2-thienyl)pyrazole-4-carbaldehyde CAS Name: 1-(1,1-dioxo-3-thiolanyl)-3-thiophen-2-yl-4-pyrazolecarboxaldehyde IUPAC Name: 1-(1,1-dioxothiolan-3-yl)-3-thiophen-2-ylpyrazole-4-carbaldehyde Traditional Name: 1-(1,1-diketothiolan-3-yl)-3-(2-thienyl)pyrazole-4-carbaldehyde Formula: C12H12N2O3S2 MolecularWeight: 296.36528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1N2C=C(C(=N2)C3=CC=CS3)C=O

Isomeric SMILES

C1CS(=O)(=O)CC1N2C=C(C(=N2)C3=CC=CS3)C=O

InChI

InChI=1S/C12H12N2O3S2/c15-7-9-6-14(10-3-5-19(16,17)8-10)13-12(9)11-2-1-4-18-11/h1-2,4,6-7,10H,3,5,8H2