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

Systemtic Name: 1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-5-chloranyl-3-methyl-pyrazole-4-carbaldehyde Openeye Name: 5-chloro-1-[(3S)-1,1-dioxothiolan-3-yl]-3-methyl-pyrazole-4-carbaldehyde CAS Name: 5-chloro-1-[(3S)-1,1-dioxo-3-thiolanyl]-3-methyl-4-pyrazolecarboxaldehyde IUPAC Name: 5-chloro-1-[(3S)-1,1-dioxothiolan-3-yl]-3-methylpyrazole-4-carbaldehyde Traditional Name: 5-chloro-1-[(3S)-1,1-diketothiolan-3-yl]-3-methyl-pyrazole-4-carbaldehyde Formula: C9H11ClN2O3S MolecularWeight: 262.71324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=O)Cl)C2CCS(=O)(=O)C2

Isomeric SMILES

CC1=NN(C(=C1C=O)Cl)[C@H]2CCS(=O)(=O)C2

InChI

InChI=1S/C9H11ClN2O3S/c1-6-8(4-13)9(10)12(11-6)7-2-3-16(14,15)5-7/h4,7H,2-3,5H2,1H3/t7-/m0/s1