N-[4-(azepan-1-yl)phenyl]-1-(4-fluorophenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-[4-(azepan-1-yl)phenyl]-1-(4-fluorophenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-[4-(azepan-1-yl)phenyl]-1-(4-fluorophenyl)sulfonyl-pyrrolidine-2-carboxamide CAS Name: N-[4-(1-azepanyl)phenyl]-1-(4-fluorophenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-[4-(azepan-1-yl)phenyl]-1-(4-fluorophenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: N-[4-(azepan-1-yl)phenyl]-1-(4-fluorophenyl)sulfonyl-pyrrolidine-2-carboxamide Formula: C23H28FN3O3S MolecularWeight: 445.550123

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)C3CCCN3S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)C3CCCN3S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H28FN3O3S/c24-18-7-13-21(14-8-18)31(29,30)27-17-5-6-22(27)23(28)25-19-9-11-20(12-10-19)26-15-3-1-2-4-16-26/h7-14,22H,1-6,15-17H2,(H,25,28)