5-[1-(phenylmethyl)sulfonylpyrrolidin-2-yl]-1H-imidazole-4-thiol

Systemtic Name: 5-[1-(phenylmethyl)sulfonylpyrrolidin-2-yl]-1H-imidazole-4-thiol Openeye Name: 5-(1-benzylsulfonylpyrrolidin-2-yl)-1H-imidazole-4-thiol CAS Name: 5-[1-(phenylmethyl)sulfonyl-2-pyrrolidinyl]-1H-imidazole-4-thiol IUPAC Name: 5-(1-benzylsulfonylpyrrolidin-2-yl)-1H-imidazole-4-thiol Traditional Name: 5-(1-benzylsulfonylpyrrolidin-2-yl)-1H-imidazole-4-thiol Formula: C14H17N3O2S2 MolecularWeight: 323.43368

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)CC2=CC=CC=C2)C3=C(N=CN3)S

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)CC2=CC=CC=C2)C3=C(N=CN3)S

InChI

InChI=1S/C14H17N3O2S2/c18-21(19,9-11-5-2-1-3-6-11)17-8-4-7-12(17)13-14(20)16-10-15-13/h1-3,5-6,10,12,20H,4,7-9H2,(H,15,16)