3-nitro-N-(5-pyrrolidin-1-ylsulfonyl-1,3,4-thiadiazol-2-yl)benzamide

Systemtic Name: 3-nitro-N-(5-pyrrolidin-1-ylsulfonyl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 3-nitro-N-(5-pyrrolidin-1-ylsulfonyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 3-nitro-N-[5-(1-pyrrolidinylsulfonyl)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 3-nitro-N-(5-pyrrolidin-1-ylsulfonyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: 3-nitro-N-(5-pyrrolidinosulfonyl-1,3,4-thiadiazol-2-yl)benzamide Formula: C13H13N5O5S2 MolecularWeight: 383.40282

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=NN=C(S2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=NN=C(S2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H13N5O5S2/c19-11(9-4-3-5-10(8-9)18(20)21)14-12-15-16-13(24-12)25(22,23)17-6-1-2-7-17/h3-5,8H,1-2,6-7H2,(H,14,15,19)