[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-[(1-phenylpyrazol-4-yl)methyl]azanium

Systemtic Name: [(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-[(1-phenylpyrazol-4-yl)methyl]azanium Openeye Name: [(3S)-1,1-dioxothiolan-3-yl]-[(1-phenylpyrazol-4-yl)methyl]ammonium CAS Name: [(3S)-1,1-dioxo-3-thiolanyl]-[(1-phenyl-4-pyrazolyl)methyl]ammonium IUPAC Name: [(3S)-1,1-dioxothiolan-3-yl]-[(1-phenylpyrazol-4-yl)methyl]azanium Traditional Name: [(3S)-1,1-diketothiolan-3-yl]-[(1-phenylpyrazol-4-yl)methyl]ammonium Formula: C14H18N3O2S+ MolecularWeight: 292.37662

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1[NH2+]CC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

C1CS(=O)(=O)C[C@H]1[NH2+]CC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C14H17N3O2S/c18-20(19)7-6-13(11-20)15-8-12-9-16-17(10-12)14-4-2-1-3-5-14/h1-5,9-10,13,15H,6-8,11H2/p+1/t13-/m0/s1