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

Systemtic Name: 1-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-chloranyl-3-propyl-pyrazole-4-carbaldehyde Openeye Name: 5-chloro-1-(1,1-dioxothiolan-3-yl)-3-propyl-pyrazole-4-carbaldehyde CAS Name: 5-chloro-1-(1,1-dioxo-3-thiolanyl)-3-propyl-4-pyrazolecarboxaldehyde IUPAC Name: 5-chloro-1-(1,1-dioxothiolan-3-yl)-3-propylpyrazole-4-carbaldehyde Traditional Name: 5-chloro-1-(1,1-diketothiolan-3-yl)-3-propyl-pyrazole-4-carbaldehyde Formula: C11H15ClN2O3S MolecularWeight: 290.7664

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1C=O)Cl)C2CCS(=O)(=O)C2

Isomeric SMILES

CCCC1=NN(C(=C1C=O)Cl)C2CCS(=O)(=O)C2

InChI

InChI=1S/C11H15ClN2O3S/c1-2-3-10-9(6-15)11(12)14(13-10)8-4-5-18(16,17)7-8/h6,8H,2-5,7H2,1H3