N-[3-(1,3-benzothiazol-2-yl)phenyl]-5-pyrrolidin-1-ylsulfonyl-furan-2-carboxamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-5-pyrrolidin-1-ylsulfonyl-furan-2-carboxamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-5-pyrrolidin-1-ylsulfonyl-furan-2-carboxamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-5-(1-pyrrolidinylsulfonyl)-2-furancarboxamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-5-pyrrolidin-1-ylsulfonylfuran-2-carboxamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-5-pyrrolidinosulfonyl-2-furamide Formula: C22H19N3O4S2 MolecularWeight: 453.53396

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(O2)C(=O)NC3=CC=CC(=C3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(O2)C(=O)NC3=CC=CC(=C3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H19N3O4S2/c26-21(18-10-11-20(29-18)31(27,28)25-12-3-4-13-25)23-16-7-5-6-15(14-16)22-24-17-8-1-2-9-19(17)30-22/h1-2,5-11,14H,3-4,12-13H2,(H,23,26)