2-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]ethanone CAS Name: 2-[2-(4-ethoxyphenyl)-1-pyrrolidinyl]-1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]ethanone Traditional Name: 1-(4-benzylsulfonylpiperazino)-2-(2-p-phenetylpyrrolidino)ethanone Formula: C25H33N3O4S MolecularWeight: 471.61222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2CCCN2CC(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)C2CCCN2CC(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C25H33N3O4S/c1-2-32-23-12-10-22(11-13-23)24-9-6-14-27(24)19-25(29)26-15-17-28(18-16-26)33(30,31)20-21-7-4-3-5-8-21/h3-5,7-8,10-13,24H,2,6,9,14-20H2,1H3