N-ethyl-4-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]sulfonyl-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: N-ethyl-4-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]sulfonyl-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-N-ethyl-4-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]sulfonyl-benzenesulfonamide CAS Name: N-ethyl-4-[[4-[(3-methoxyphenyl)methyl]-1-piperazinyl]sulfonyl]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-N-ethyl-4-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]sulfonylbenzenesulfonamide Traditional Name: N-benzyl-N-ethyl-4-(4-m-anisylpiperazino)sulfonyl-benzenesulfonamide Formula: C27H33N3O5S2 MolecularWeight: 543.69802

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)CC4=CC(=CC=C4)OC

Isomeric SMILES

CCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)CC4=CC(=CC=C4)OC

InChI

InChI=1S/C27H33N3O5S2/c1-3-29(22-23-8-5-4-6-9-23)36(31,32)26-12-14-27(15-13-26)37(33,34)30-18-16-28(17-19-30)21-24-10-7-11-25(20-24)35-2/h4-15,20H,3,16-19,21-22H2,1-2H3