3-nitro-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]benzamide

Systemtic Name: 3-nitro-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]benzamide Openeye Name: 3-nitro-N-[(5-pyrrolidin-1-ylsulfonyl-2-thienyl)methyl]benzamide CAS Name: 3-nitro-N-[[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]methyl]benzamide IUPAC Name: 3-nitro-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]benzamide Traditional Name: 3-nitro-N-[(5-pyrrolidinosulfonyl-2-thienyl)methyl]benzamide Formula: C16H17N3O5S2 MolecularWeight: 395.45328

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3O5S2/c20-16(12-4-3-5-13(10-12)19(21)22)17-11-14-6-7-15(25-14)26(23,24)18-8-1-2-9-18/h3-7,10H,1-2,8-9,11H2,(H,17,20)