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

Systemtic Name: 1-[1,1-bis(oxidanylidene)thiolan-3-yl]-3-(2-chlorophenyl)pyrazole-4-carbaldehyde Openeye Name: 3-(2-chlorophenyl)-1-(1,1-dioxothiolan-3-yl)pyrazole-4-carbaldehyde CAS Name: 3-(2-chlorophenyl)-1-(1,1-dioxo-3-thiolanyl)-4-pyrazolecarboxaldehyde IUPAC Name: 3-(2-chlorophenyl)-1-(1,1-dioxothiolan-3-yl)pyrazole-4-carbaldehyde Traditional Name: 3-(2-chlorophenyl)-1-(1,1-diketothiolan-3-yl)pyrazole-4-carbaldehyde Formula: C14H13ClN2O3S MolecularWeight: 324.78262

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1N2C=C(C(=N2)C3=CC=CC=C3Cl)C=O

Isomeric SMILES

C1CS(=O)(=O)CC1N2C=C(C(=N2)C3=CC=CC=C3Cl)C=O

InChI

InChI=1S/C14H13ClN2O3S/c15-13-4-2-1-3-12(13)14-10(8-18)7-17(16-14)11-5-6-21(19,20)9-11/h1-4,7-8,11H,5-6,9H2