N-(6-fluoranyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(6-fluoranyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-N-(2-furfuryl)-4-pyrrolidinosulfonyl-benzamide Formula: C23H20FN3O4S2 MolecularWeight: 485.551003

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CC3=CC=CO3)C4=NC5=C(S4)C=C(C=C5)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CC3=CC=CO3)C4=NC5=C(S4)C=C(C=C5)F

InChI

InChI=1S/C23H20FN3O4S2/c24-17-7-10-20-21(14-17)32-23(25-20)27(15-18-4-3-13-31-18)22(28)16-5-8-19(9-6-16)33(29,30)26-11-1-2-12-26/h3-10,13-14H,1-2,11-12,15H2