1-cyclopropyl-2-(4-nitro-2-pyrrolidin-1-ylsulfonyl-phenyl)sulfanyl-imidazole

Systemtic Name: 1-cyclopropyl-2-(4-nitro-2-pyrrolidin-1-ylsulfonyl-phenyl)sulfanyl-imidazole Openeye Name: 1-cyclopropyl-2-(4-nitro-2-pyrrolidin-1-ylsulfonyl-phenyl)sulfanyl-imidazole CAS Name: 1-cyclopropyl-2-[[4-nitro-2-(1-pyrrolidinylsulfonyl)phenyl]thio]imidazole IUPAC Name: 1-cyclopropyl-2-(4-nitro-2-pyrrolidin-1-ylsulfonylphenyl)sulfanylimidazole Traditional Name: 1-cyclopropyl-2-[(4-nitro-2-pyrrolidinosulfonyl-phenyl)thio]imidazole Formula: C16H18N4O4S2 MolecularWeight: 394.46852

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])SC3=NC=CN3C4CC4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])SC3=NC=CN3C4CC4

InChI

InChI=1S/C16H18N4O4S2/c21-20(22)13-5-6-14(25-16-17-7-10-19(16)12-3-4-12)15(11-13)26(23,24)18-8-1-2-9-18/h5-7,10-12H,1-4,8-9H2