1-(4-fluorophenyl)sulfonyl-N-(6-nitro-1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide

Systemtic Name: 1-(4-fluorophenyl)sulfonyl-N-(6-nitro-1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide Openeye Name: 1-(4-fluorophenyl)sulfonyl-N-(6-nitro-1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide CAS Name: 1-(4-fluorophenyl)sulfonyl-N-(6-nitro-1,3-benzothiazol-2-yl)-2-pyrrolidinecarboxamide IUPAC Name: 1-(4-fluorophenyl)sulfonyl-N-(6-nitro-1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide Traditional Name: 1-(4-fluorophenyl)sulfonyl-N-(6-nitro-1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide Formula: C18H15FN4O5S2 MolecularWeight: 450.463903

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H15FN4O5S2/c19-11-3-6-13(7-4-11)30(27,28)22-9-1-2-15(22)17(24)21-18-20-14-8-5-12(23(25)26)10-16(14)29-18/h3-8,10,15H,1-2,9H2,(H,20,21,24)