N-[(2S)-2-(furan-2-yl)-2-(4-phenylpiperazin-1-yl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-[(2S)-2-(furan-2-yl)-2-(4-phenylpiperazin-1-yl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-[(2S)-2-(2-furyl)-2-(4-phenylpiperazin-1-yl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[(2S)-2-(2-furanyl)-2-(4-phenyl-1-piperazinyl)ethyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-[(2S)-2-(furan-2-yl)-2-(4-phenylpiperazin-1-yl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-[(2S)-2-(2-furyl)-2-(4-phenylpiperazino)ethyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C24H27N3O5S MolecularWeight: 469.55328

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(CNS(=O)(=O)C3=CC4=C(C=C3)OCCO4)C5=CC=CO5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)[C@@H](CNS(=O)(=O)C3=CC4=C(C=C3)OCCO4)C5=CC=CO5

InChI

InChI=1S/C24H27N3O5S/c28-33(29,20-8-9-23-24(17-20)32-16-15-31-23)25-18-21(22-7-4-14-30-22)27-12-10-26(11-13-27)19-5-2-1-3-6-19/h1-9,14,17,21,25H,10-13,15-16,18H2/t21-/m0/s1