N-[2-[(2S)-butan-2-yl]-1H-pyrazol-2-ium-3-yl]thiophene-2-sulfonamide

Systemtic Name: N-[2-[(2S)-butan-2-yl]-1H-pyrazol-2-ium-3-yl]thiophene-2-sulfonamide Openeye Name: N-[2-[(1S)-1-methylpropyl]-1H-pyrazol-2-ium-3-yl]thiophene-2-sulfonamide CAS Name: N-[2-[(2S)-butan-2-yl]-1H-pyrazol-2-ium-3-yl]-2-thiophenesulfonamide IUPAC Name: N-[2-[(2S)-butan-2-yl]-1H-pyrazol-2-ium-3-yl]thiophene-2-sulfonamide Traditional Name: N-[2-[(1S)-1-methylpropyl]-1H-pyrazol-2-ium-3-yl]thiophene-2-sulfonamide Formula: C11H16N3O2S2+ MolecularWeight: 286.39364

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[N+]1=C(C=CN1)NS(=O)(=O)C2=CC=CS2

Isomeric SMILES

CC[C@H](C)[N+]1=C(C=CN1)NS(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C11H15N3O2S2/c1-3-9(2)14-10(6-7-12-14)13-18(15,16)11-5-4-8-17-11/h4-9H,3H2,1-2H3,(H,12,13)/p+1/t9-/m0/s1