1-[1,1-bis(oxidanylidene)thiolan-3-yl]-3-(5-methylthiophen-2-yl)pyrazole-4-carbaldehyde

Systemtic Name: 1-[1,1-bis(oxidanylidene)thiolan-3-yl]-3-(5-methylthiophen-2-yl)pyrazole-4-carbaldehyde Openeye Name: 1-(1,1-dioxothiolan-3-yl)-3-(5-methyl-2-thienyl)pyrazole-4-carbaldehyde CAS Name: 1-(1,1-dioxo-3-thiolanyl)-3-(5-methyl-2-thiophenyl)-4-pyrazolecarboxaldehyde IUPAC Name: 1-(1,1-dioxothiolan-3-yl)-3-(5-methylthiophen-2-yl)pyrazole-4-carbaldehyde Traditional Name: 1-(1,1-diketothiolan-3-yl)-3-(5-methyl-2-thienyl)pyrazole-4-carbaldehyde Formula: C13H14N2O3S2 MolecularWeight: 310.39186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2=NN(C=C2C=O)C3CCS(=O)(=O)C3

Isomeric SMILES

CC1=CC=C(S1)C2=NN(C=C2C=O)C3CCS(=O)(=O)C3

InChI

InChI=1S/C13H14N2O3S2/c1-9-2-3-12(19-9)13-10(7-16)6-15(14-13)11-4-5-20(17,18)8-11/h2-3,6-7,11H,4-5,8H2,1H3