[4-[4-(azepan-1-ylsulfonyl)phenyl]sulfonylpiperazin-1-yl]-(2-fluorophenyl)methanone

Systemtic Name: [4-[4-(azepan-1-ylsulfonyl)phenyl]sulfonylpiperazin-1-yl]-(2-fluorophenyl)methanone Openeye Name: [4-[4-(azepan-1-ylsulfonyl)phenyl]sulfonylpiperazin-1-yl]-(2-fluorophenyl)methanone CAS Name: [4-[4-(1-azepanylsulfonyl)phenyl]sulfonyl-1-piperazinyl]-(2-fluorophenyl)methanone IUPAC Name: [4-[4-(azepan-1-ylsulfonyl)phenyl]sulfonylpiperazin-1-yl]-(2-fluorophenyl)methanone Traditional Name: [4-[4-(azepan-1-ylsulfonyl)phenyl]sulfonylpiperazino]-(2-fluorophenyl)methanone Formula: C23H28FN3O5S2 MolecularWeight: 509.613923

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)C4=CC=CC=C4F

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)C4=CC=CC=C4F

InChI

InChI=1S/C23H28FN3O5S2/c24-22-8-4-3-7-21(22)23(28)25-15-17-27(18-16-25)34(31,32)20-11-9-19(10-12-20)33(29,30)26-13-5-1-2-6-14-26/h3-4,7-12H,1-2,5-6,13-18H2