[1-(3-methoxyphenyl)carbonyl-4-[2-(phenylsulfonyl)ethyl]piperazin-2-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [1-(3-methoxyphenyl)carbonyl-4-[2-(phenylsulfonyl)ethyl]piperazin-2-yl]-pyrrolidin-1-yl-methanone Openeye Name: [4-[2-(benzenesulfonyl)ethyl]-1-(3-methoxybenzoyl)piperazin-2-yl]-pyrrolidin-1-yl-methanone CAS Name: [4-[2-(benzenesulfonyl)ethyl]-1-[(3-methoxyphenyl)-oxomethyl]-2-piperazinyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-[2-(benzenesulfonyl)ethyl]-1-(3-methoxybenzoyl)piperazin-2-yl]-pyrrolidin-1-ylmethanone Traditional Name: [4-(2-besylethyl)-1-m-anisoyl-piperazin-2-yl]-pyrrolidino-methanone Formula: C25H31N3O5S MolecularWeight: 485.59574

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N2CCN(CC2C(=O)N3CCCC3)CCS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2CCN(CC2C(=O)N3CCCC3)CCS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H31N3O5S/c1-33-21-9-7-8-20(18-21)24(29)28-15-14-26(19-23(28)25(30)27-12-5-6-13-27)16-17-34(31,32)22-10-3-2-4-11-22/h2-4,7-11,18,23H,5-6,12-17,19H2,1H3