N-cyclopropyl-N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-4-fluoranyl-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-cyclopropyl-N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-4-fluoranyl-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-cyclopropyl-N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-4-fluoro-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-cyclopropyl-N-[[4-[(cyclopropylamino)-oxomethyl]phenyl]methyl]-4-fluoro-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-cyclopropyl-N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-4-fluoro-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-cyclopropyl-N-[4-(cyclopropylcarbamoyl)benzyl]-4-fluoro-3-pyrrolidinosulfonyl-benzamide Formula: C25H28FN3O4S MolecularWeight: 485.570923

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N(CC3=CC=C(C=C3)C(=O)NC4CC4)C5CC5)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N(CC3=CC=C(C=C3)C(=O)NC4CC4)C5CC5)F

InChI

InChI=1S/C25H28FN3O4S/c26-22-12-7-19(15-23(22)34(32,33)28-13-1-2-14-28)25(31)29(21-10-11-21)16-17-3-5-18(6-4-17)24(30)27-20-8-9-20/h3-7,12,15,20-21H,1-2,8-11,13-14,16H2,(H,27,30)