1-(3-fluorophenyl)sulfonyl-5-[4-(phenylmethyl)piperazin-1-yl]indole

Systemtic Name: 1-(3-fluorophenyl)sulfonyl-5-[4-(phenylmethyl)piperazin-1-yl]indole Openeye Name: 5-(4-benzylpiperazin-1-yl)-1-(3-fluorophenyl)sulfonyl-indole CAS Name: 1-(3-fluorophenyl)sulfonyl-5-[4-(phenylmethyl)-1-piperazinyl]indole IUPAC Name: 5-(4-benzylpiperazin-1-yl)-1-(3-fluorophenyl)sulfonylindole Traditional Name: 5-(4-benzylpiperazino)-1-(3-fluorophenyl)sulfonyl-indole Formula: C25H24FN3O2S MolecularWeight: 449.540363

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=CC4=C(C=C3)N(C=C4)S(=O)(=O)C5=CC=CC(=C5)F

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=CC4=C(C=C3)N(C=C4)S(=O)(=O)C5=CC=CC(=C5)F

InChI

InChI=1S/C25H24FN3O2S/c26-22-7-4-8-24(18-22)32(30,31)29-12-11-21-17-23(9-10-25(21)29)28-15-13-27(14-16-28)19-20-5-2-1-3-6-20/h1-12,17-18H,13-16,19H2