4-fluoranyl-N-[4-(pyridin-4-ylmethyl)phenyl]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-fluoranyl-N-[4-(pyridin-4-ylmethyl)phenyl]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 4-fluoro-N-[4-(4-pyridylmethyl)phenyl]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 4-fluoro-N-[4-(pyridin-4-ylmethyl)phenyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 4-fluoro-N-[4-(pyridin-4-ylmethyl)phenyl]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 4-fluoro-N-[4-(4-pyridylmethyl)phenyl]-3-pyrrolidinosulfonyl-benzamide Formula: C23H22FN3O3S MolecularWeight: 439.502483

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC=C(C=C3)CC4=CC=NC=C4)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC=C(C=C3)CC4=CC=NC=C4)F

InChI

InChI=1S/C23H22FN3O3S/c24-21-8-5-19(16-22(21)31(29,30)27-13-1-2-14-27)23(28)26-20-6-3-17(4-7-20)15-18-9-11-25-12-10-18/h3-12,16H,1-2,13-15H2,(H,26,28)