N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-4-bromanyl-1-ethyl-pyrazole-3-carboxamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-4-bromanyl-1-ethyl-pyrazole-3-carboxamide Openeye Name: 4-bromo-N-[(3S)-1,1-dioxothiolan-3-yl]-1-ethyl-pyrazole-3-carboxamide CAS Name: 4-bromo-N-[(3S)-1,1-dioxo-3-thiolanyl]-1-ethyl-3-pyrazolecarboxamide IUPAC Name: 4-bromo-N-[(3S)-1,1-dioxothiolan-3-yl]-1-ethylpyrazole-3-carboxamide Traditional Name: 4-bromo-N-[(3S)-1,1-diketothiolan-3-yl]-1-ethyl-pyrazole-3-carboxamide Formula: C10H14BrN3O3S MolecularWeight: 336.20546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC2CCS(=O)(=O)C2)Br

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)N[C@H]2CCS(=O)(=O)C2)Br

InChI

InChI=1S/C10H14BrN3O3S/c1-2-14-5-8(11)9(13-14)10(15)12-7-3-4-18(16,17)6-7/h5,7H,2-4,6H2,1H3,(H,12,15)/t7-/m0/s1